Datasets:
Derify
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ReactionSmiles

Dataset card Data Studio Files
xet
 Community
1
smiles
stringlengths
15
6.12k
source_id
int64
1
5
C(C1=CC=CC=C1)OCCC(C(=O)C1=CC=C(C=C1)OCCN(C)C)C1=CC=C(C=C1)Cl>>C(C1=CC=CC=C1)OCCC(C(O)(C1=CC=CC=C1)C1=CC=C(C=C1)OCCN(C)C)C1=CC=C(C=C1)Cl
5
[Br:1]C1C=C(OC)C=CC=1.[Mg:10].[O:11]1[C:20]2[C:15](=[CH:16][CH:17]=[CH:18][CH:19]=2)C(=O)C[CH2:12]1.Cl>O1CCCC1.O>[CH3:12][O:11][C:20]1[CH:15]=[C:16]([Mg:10][Br:1])[CH:17]=[CH:18][CH:19]=1
1
[CH:1]1[C:13]2[CH:12]([CH2:14][O:15][C:16]([NH:18][C@H:19]([C:25]([OH:27])=[O:26])[CH2:20][CH2:21][CH2:22][CH2:23][NH2:24])=[O:17])[C:11]3[C:6](=[CH:7][CH:8]=[CH:9][CH:10]=3)[C:5]=2[CH:4]=[CH:3][CH:2]=1.[I:28][C:29]1[CH:34]=[CH:33][C:32]([S:35](Cl)(=[O:37])=[O:36])=[CH:31][CH:30]=1>>[I:28][C:29]1[CH:34]=[CH:33][C:32]([S:35]([NH:24][CH2:23][CH2:22][CH2:21][CH2:20][C@@H:19]([C:25]([OH:27])=[O:26])[NH:18][C:16]([O:15][CH2:14][CH:12]2[C:11]3[CH:10]=[CH:9][CH:8]=[CH:7][C:6]=3[C:5]3[C:13]2=[CH:1][CH:2]=[CH:3][CH:4]=3)=[O:17])(=[O:37])=[O:36])=[CH:31][CH:30]=1
1
C(C1=CC=CC=C1)OC1=C(C=C(OC2=C(C=C(C=3CCCC23)C=O)C)C=C1)C(C)C>>C(=O)OC1=C2CCCC2=C(C(=C1)C)OC1=CC(=C(C=C1)OCC1=CC=CC=C1)C(C)C
5
Cl.COC.[C:5]([C:9]1[CH:16]=[CH:15][C:12]([CH2:13]O)=[CH:11][CH:10]=1)([O:7]C)=[O:6].[CH2:17]([C:21]1[N:22](CC2C=CC=CC=2Cl)[C:23](/[CH:26]=[C:27](\[CH2:31][C:32]2[S:33][CH:34]=[CH:35][CH:36]=2)/[C:28]([OH:30])=[O:29])=[CH:24][N:25]=1)[CH2:18][CH2:19]C>>[CH2:17]([C:21]1[N:22]([CH2:13][C:12]2[CH:15]=[CH:16][C:9]([C:5]([OH:7])=[O:6])=[CH:10][CH:11]=2)[C:23](/[CH:26]=[C:27](\[CH2:31][C:32]2[S:33][CH:34]=[CH:35][CH:36]=2)/[C:28]([OH:30])=[O:29])=[CH:24][N:25]=1)[CH2:18][CH3:19]
1
NCCC[Si](OCC)(OCC)OCC.C(C1CO1)CCC[Si](OCC)(OCC)OCC>>CO[Si](CCCOCC1CO1)(OC)OC.CCO[Si](CCCN)(OCC)OCC
5
[H-].[Na+].[C:3]([NH:6][CH:7]([C:13]([O:15][CH2:16][CH3:17])=[O:14])[C:8]([O:10][CH2:11][CH3:12])=[O:9])(=[O:5])[CH3:4].Br[CH2:19][C:20]([C:22]1[CH:27]=[CH:26][C:25]([O:28][C:29]2[CH:34]=[CH:33][C:32]([C:35]3[N:40]=[CH:39][CH:38]=[CH:37][N:36]=3)=[CH:31][CH:30]=2)=[CH:24][CH:23]=1)=[O:21]>C1COCC1>[C:3]([NH:6][C:7]([CH2:19][C:20](=[O:21])[C:22]1[CH:23]=[CH:24][C:25]([O:28][C:29]2[CH:34]=[CH:33][C:32]([C:35]3[N:36]=[CH:37][CH:38]=[CH:39][N:40]=3)=[CH:31][CH:30]=2)=[CH:26][CH:27]=1)([C:13]([O:15][CH2:16][CH3:17])=[O:14])[C:8]([O:10][CH2:11][CH3:12])=[O:9])(=[O:5])[CH3:4]
2
N[C@H](C(O)=O)C.[NH2:7][C@H:8]([C:17]([OH:19])=[O:18])[CH2:9][C:10]1[CH:15]=[CH:14][C:13](O)=[CH:12][CH:11]=1.NCC(O)=O>>[NH2:7][C@H:8]([C:17]([OH:19])=[O:18])[CH2:9][C:10]1[CH:15]=[CH:14][CH:13]=[CH:12][CH:11]=1
1
C(C=C)I.FC(C(CCC#C[Si](C(C)C)(C(C)C)C(C)C)NC(OC(C)(C)C)=O)F>N(C)(C)C=O.[H-].[Na+].[Cl-].[NH4+]>C(C=C)N(C(OC(C)(C)C)=O)C(CCC#C[Si](C(C)C)(C(C)C)C(C)C)C(F)F
3
CN.N(C(=N)N)C=1SC=C(N1)C1CC(CCC1)NC1=C(C(C1=O)=O)OC>CCO[H].C(Cl)(Cl)Cl.CO>N(C(=N)N)C=1SC=C(N1)C1CC(CCC1)NC1=C(C(C1=O)=O)NC
3
[Cl:1][C:2]1[N:3]=[C:4]([N+:11]([O-:13])=[O:12])[C:5]([NH2:10])=[N:6][C:7]=1[NH:8][NH2:9].[CH2:14](OC(OCC)OCC)C>>[Cl:1][C:2]1[C:7]2[N:6]([CH:14]=[N:9][N:8]=2)[C:5]([NH2:10])=[C:4]([N+:11]([O-:13])=[O:12])[N:3]=1
1
C12C3C(OC(C3C(C=C1)CC2)=O)=O>>C12C3C(OC(C3C(CC1)CC2)=O)=O
5
FC1=C(C=CC(=C1)O)B(O)O.FC1(CN(CC1)C1=NC=CC(=C1NC(=O)C=1C=NC(=NC1)C(C)C)I)F>O.ClCCl.C([O-])([O-])=O.[K+].[K+].O1CCOCC1.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.Cl[Pd]Cl.[Fe+2]>FC1(CN(CC1)C1=NC=CC(=C1NC(=O)C=1C=NC(=NC1)C(C)C)C1=C(C=C(C=C1)O)F)F
3
C(C)OC(C=CC=1SC(=CC1)C=CC(=O)OCC)=O>CO[H].[HH].[Pd]>C(C)OC(CCC=1SC(=CC1)CCC(=O)OCC)=O
3
C(C)I.BrC=1C=C2CC(NC3(COC3)C2=CC1)=O>N(C)(C)C=O.O.[H-].[Na+]>BrC=1C=C2C(C(NC3(COC3)C2=CC1)=O)(CC)CC
3
ClC1=C(N=NC=C1N1CCC(CC1)C1=NC=CC=C1OC)NNC(CC(F)(F)F)=O>>ClC=1C=2N(N=CC1N1CCC(CC1)C1=NC=CC=C1OC)C(=NN2)CC(F)(F)F
5
C1(=CC=CC=C1)COC1=CC=C(C=O)C=C1.NC=1C=CC(=NC1N)C1CCN(CC1)C(=O)OC(C)(C)C>O.C(C)(=O)O[IH]C1=C(C=CC=C1)[IH]OC(C)=O>C(C1=CC=CC=C1)OC1=CC=C(C=C1)C1=NC=2C(=NC(=CC2)C2CCN(CC2)C(=O)OC(C)(C)C)N1
3
COC([C@H]1N(C[C@@H](C1)O)C(=O)OC(C)(C)C)=O.FC(C=1C=CC(=CC1)O)(F)F>C1CCCO1.c3c(P(c1ccccc1)c2ccccc2)cccc3.N(=NC(=O)OC(C)C)C(=O)OC(C)C>FC(C1=CC=C(O[C@H]2C[C@H](N(C2)C(=O)OC(C)(C)C)C(=O)OC)C=C1)(F)F
3
[C-]#N.[Na+].[2H]C1(CN(CC(C1OS(=O)(=O)C)([2H])[2H])C(=O)OC(C)(C)C)[2H]>O.CS(=O)C>C(#N)C1C(CN(CC1([2H])[2H])C(=O)OC(C)(C)C)([2H])[2H]
3
P(=O)(OCC)(OCC)Cl.OCCCCNC(C(C)C1=CC=C(C=C1)CC(C)C)=O>>C(C(C)C)C1=CC=C(C=C1)C(C(=O)NCCCCOP(OCC)(OCC)=O)C
5
[N+](=O)([O-])C=1C=C(C(=O)O)C=CC1NCCC>CO[H].[HH].[Al].[Ni]>NC=1C=C(C(=O)O)C=CC1NCCC
3
[NH:1]([C:23]([O:25][C:26]([CH3:29])([CH3:28])[CH3:27])=[O:24])[C@H:2]([C:20]([OH:22])=O)[CH2:3][CH2:4][CH2:5][NH:6][C:7](=[NH:19])[NH:8][S:9]([C:12]1[CH:18]=[CH:17][C:15]([CH3:16])=[CH:14][CH:13]=1)(=[O:11])=[O:10].C1C=CC(P(N=[N+]=[N-])(C2C=CC=CC=2)=O)=CC=1.CCN(C(C)C)C(C)C.Cl.[NH2:57][C@H:58]([C:74]([O:76][CH3:77])=[O:75])[CH2:59][C:60]1[CH:65]=[CH:64][C:63]([O:66][CH2:67][C:68]2[CH:73]=[CH:72][CH:71]=[CH:70][CH:69]=2)=[CH:62][CH:61]=1>CN(C=O)C>[NH:1]([C:23]([O:25][C:26]([CH3:29])([CH3:27])[CH3:28])=[O:24])[C@H:2]([C:20]([NH:57][C@H:58]([C:74]([O:76][CH3:77])=[O:75])[CH2:59][C:60]1[CH:61]=[CH:62][C:63]([O:66][CH2:67][C:68]2[CH:69]=[CH:70][CH:71]=[CH:72][CH:73]=2)=[CH:64][CH:65]=1)=[O:22])[CH2:3][CH2:4][CH2:5][NH:6][C:7](=[NH:19])[NH:8][S:9]([C:12]1[CH:18]=[CH:17][C:15]([CH3:16])=[CH:14][CH:13]=1)(=[O:10])=[O:11]
1
N1N=CC=C1.C(C)OC(=O)C1(N(C(CC1)=O)C=1C=NC(=CC1)OC1=CC=C(C=C1)CBr)C(=O)OCC>N(C)(C)C=O.C([O-])([O-])=O.[K+].[K+]>C(C)OC(=O)C1(N(C(CC1)=O)C=1C=NC(=CC1)OC1=CC=C(C=C1)CN1N=CC=C1)C(=O)OCC
3
[C:1]1(=[O:11])[NH:5][C:4](=[O:6])[C:3]2=[CH:7][CH:8]=[CH:9][CH:10]=[C:2]12.C1C=CC(P(C2C=CC=CC=2)C2C=CC=CC=2)=CC=1.[N:31]1[CH:36]=[CH:35][CH:34]=[C:33]([CH2:37][CH2:38][CH2:39]O)[CH:32]=1.N(C(OCC)=O)=NC(OCC)=O>O1CCCC1.C(Cl)Cl.O>[N:31]1[CH:36]=[CH:35][CH:34]=[C:33]([CH2:37][CH2:38][CH2:39][N:5]2[C:1](=[O:11])[C:2]3[C:3](=[CH:7][CH:8]=[CH:9][CH:10]=3)[C:4]2=[O:6])[CH:32]=1
1
[Si:1]([O-])([O-])([O-])[O-:2].[Na+].[Na+].[Na+].[Na+].S(=O)(=O)(O)[OH:11].[O:15](Cl)Cl.[Zr:18].[OH-:19].[Na+].[O:21]=[Al-:22]=O.[Na+]>[O-2].[Ti+4].[O-2].O>[OH-:2].[Si+4:1].[OH-:11].[OH-:15].[OH-:21].[OH-:19].[Zr+4:18].[OH-:2].[OH-:2].[OH-:2].[OH-:2].[Al+3:22].[OH-:2].[OH-:2]
1
C(N(CC)CC)C.[CH3:8][N:9]1[C:13]([NH2:14])=[CH:12][CH:11]=[N:10]1.[CH:15]1[C:24]2[C:19](=[CH:20][CH:21]=[CH:22][CH:23]=2)[CH:18]=[C:17]2[C:25]([O:27][C:28](=O)[C:16]=12)=[O:26]>C1(C)C=CC=CC=1>[CH3:8][N:9]1[C:13]([N:14]2[C:28](=[O:27])[C:16]3[CH:15]=[C:24]4[CH:23]=[CH:22][CH:21]=[CH:20][C:19]4=[CH:18][C:17]=3[C:25]2=[O:26])=[CH:12][CH:11]=[N:10]1
1
C(N(S(F)(F)[F:7])CC)C.O[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][N:17]1[C:22](=[O:23])[CH:21]2[CH:19]([CH2:20]2)[C:18]1=[O:24].O>ClCCl>[F:7][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][N:17]1[C:22](=[O:23])[CH:21]2[CH:19]([CH2:20]2)[C:18]1=[O:24]
1
O1C(CCCC1)N1N=CC(=C1)B1OC(C(O1)(C)C)(C)C.ClC1=CC(=C2C(=C3N(C2=C1Cl)CCCC3NC(C)=O)I)OCC#N>O.O1CCOCC1.C([O-])([O-])=O.[Na+].[Na+].[Pd](Cl)Cl.C(C)(C)(C)P([C-]1C=CC=C1)C(C)(C)C.[C-]1(C=CC=C1)P(C(C)(C)C)C(C)(C)C.[Fe+2]>ClC1=CC(=C2C(=C3N(C2=C1Cl)CCCC3NC(C)=O)C=3C=NN(C3)C3OCCCC3)OCC#N
3
CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H](C)C1(CCCC1)O>N(C)(C)C=O.O.CCN(CC)CC.C1(=CC=CC=C1)S>CC1=CC=C(C=C1)S(=O)(=O)OC[C@H](C)C1(CCCC1)O
3
Cl.[CH3:2][O:3][C:4]1[CH:5]=[C:6]2[C:11](=[CH:12][CH:13]=1)[CH2:10][NH:9][CH2:8][CH2:7]2.[CH3:14][O:15][C:16]([C:18]1[CH:23]=[CH:22][C:21](B(O)O)=[CH:20][CH:19]=1)=[O:17].N1C=CC=CC=1>C(Cl)Cl.C(Cl)Cl.CO.CC([O-])=O.CC([O-])=O.[Cu+2]>[CH3:2][O:3][C:4]1[CH:5]=[C:6]2[C:11](=[CH:12][CH:13]=1)[CH2:10][N:9]([C:21]1[CH:22]=[CH:23][C:18]([C:16]([O:15][CH3:14])=[O:17])=[CH:19][CH:20]=1)[CH2:8][CH2:7]2
2
NC[C@H](C)O.CC=1C=C(C=C2C=C(NC12)C=1SC(CN1)CC(=O)O)OC=1C=NC(=CC1)S(=O)(=O)C>N(C)(C)C=O.Cl.C(C)N=C=NCCCN(C)C.OC1=CC=CC=2NN=NC21>O[C@H](CNC(CC1CN=C(S1)C=1NC2=C(C=C(C=C2C1)OC=1C=NC(=CC1)S(=O)(=O)C)C)=O)C
3
CN(CC(=O)N1CCC2=CC(=CC=C12)[N+](=O)[O-])C>CO[H].[HH].[Pd]>CN(CC(=O)N1CCC2=CC(=CC=C12)N)C
3
C(C)C1=CC(=C(C=C1C)NC(C)=O)[N+](=O)[O-]>>C(C)C1=CC(=C(N)C=C1C)[N+](=O)[O-]
5
I[C:2]1[CH:7]=[CH:6][C:5]([CH3:8])=[CH:4][CH:3]=1.[C:9]1([SH:15])[CH:14]=[CH:13][CH:12]=[CH:11][CH:10]=1>>[C:5]1([CH3:8])[CH:6]=[CH:7][CH:2]=[CH:3][C:4]=1[C:12]1[CH:13]=[CH:14][C:9]([SH:15])=[CH:10][CH:11]=1
1
C1(=CC=CC=C1)C(C)C.BrCC(=O)O.ClC1=CC2=C(N=C(S2)C)S1>>[Br-].C(=O)(O)C[N+]1=C(SC2=C1SC(=C2)Cl)C
5
FC(S(=O)(=O)OC1=CC=C(C=C1)C1=NC(=C(N=C1C)C)C(N)=O)(F)F>ClCCl.O1CCOCC1.B1(OC(C(O1)(C)C)(C)C)B2OC(C(O2)(C)C)(C)C.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P([C-]2C=CC=C2)C3=CC=CC=C3.Cl[Pd]Cl.[Fe+2].C1(=CC=CC=C1)P([C-]1C=CC=C1)C1=CC=CC=C1.[C-]1(C=CC=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.[Fe+2].C(C)(=O)[O-].[K+]>CC=1C(=NC(=C(N1)C)C1=CC=C(C=C1)B1OC(C(O1)(C)C)(C)C)C(=O)N
3
C(C=C)N1C[C@@H](N(C[C@H]1C)[C@@H](C=1C=C(C=CC1)O)C=1C=NC=CC1)C>>FC(S(=O)(=O)OC1=CC(=CC=C1)[C@@H](C=1C=NC=CC1)N1[C@H](CN([C@@H](C1)C)CC=C)C)(F)F
5
ClC1=CC=C(C=C1)C=1C=CC(=C(C1)Br)C>>ClC1=CC=C(C=C1)C=1C=CC(=C(C1)B(O)O)C
5
[C:1]1([C@@H:13]2[CH2:18][CH2:17][CH2:16][N:15](C(OC(C)(C)C)=O)[CH2:14]2)[N:5]2[C:6]3[CH:12]=[CH:11][NH:10][C:7]=3[N:8]=[CH:9][C:4]2=[CH:3][N:2]=1.O1CCOCC1.[ClH:32]>CCOCC>[ClH:32].[NH:15]1[CH2:16][CH2:17][CH2:18][C@@H:13]([C:1]2[N:5]3[C:6]4[CH:12]=[CH:11][NH:10][C:7]=4[N:8]=[CH:9][C:4]3=[CH:3][N:2]=2)[CH2:14]1
1
[CH2:1]([O:8][C:9]1[CH:14]=[CH:13][C:12]([CH2:15][C:16]([N:18]2[CH2:23][CH2:22][C:21]3[O:24][C:25]([CH2:27][N:28]([CH3:30])[CH3:29])=[CH:26][C:20]=3[CH2:19]2)=[O:17])=[CH:11][C:10]=1[O:31][CH3:32])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[ClH:33]>CO.C(OCC)(=O)C>[ClH:33].[CH2:1]([O:8][C:9]1[CH:14]=[CH:13][C:12]([CH2:15][C:16]([N:18]2[CH2:23][CH2:22][C:21]3[O:24][C:25]([CH2:27][N:28]([CH3:30])[CH3:29])=[CH:26][C:20]=3[CH2:19]2)=[O:17])=[CH:11][C:10]=1[O:31][CH3:32])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1
1
CC(C(=O)OCC)C(=O)C(F)(F)F>CO[H].C[O-].[Na+].NC(=O)N>CC=1C(NC(NC1C(F)(F)F)=O)=O
3
O(C(C)(C)C)C.C12(CC3CC(CC(C1)C3)C2)C(=O)Cl.C(C(=C)C)(=O)N>>C(C(=C)C)(=O)N.C12(CC3CC(CC(C1)C3)C2)C(=O)O
5
Cl[C:2]1[C:7]([N+:8]([O-:10])=[O:9])=[C:6]([NH2:11])[CH:5]=[C:4]([Cl:12])[N:3]=1.[CH3:13][O-:14].[Na+]>CO.CCCCCC>[Cl:12][C:4]1[N:3]=[C:2]([O:14][CH3:13])[C:7]([N+:8]([O-:10])=[O:9])=[C:6]([NH2:11])[CH:5]=1
1
Cl[C:2]1[CH:7]=[C:6]([C:8]([NH:10][C:11]2[CH:12]=[C:13]([CH:29]=[CH:30][CH:31]=2)[CH2:14][NH:15][C:16]2[C:25]3[C:20](=[C:21]([C:26]([NH2:28])=[O:27])[CH:22]=[CH:23][CH:24]=3)[N:19]=[CH:18][N:17]=2)=[O:9])[CH:5]=[CH:4][N:3]=1.CC(O)(C)C.CS(C)=O.[NH:41]1[CH2:45][CH2:44][CH2:43][CH2:42]1>O>[N:41]1([C:2]2[CH:7]=[C:6]([C:8]([NH:10][C:11]3[CH:12]=[C:13]([CH:29]=[CH:30][CH:31]=3)[CH2:14][NH:15][C:16]3[C:25]4[C:20](=[C:21]([C:26]([NH2:28])=[O:27])[CH:22]=[CH:23][CH:24]=4)[N:19]=[CH:18][N:17]=3)=[O:9])[CH:5]=[CH:4][N:3]=2)[CH2:45][CH2:44][CH2:43][CH2:42]1
1
ClC1=NN(C(=C1C)C=1C=C(SC1)C(=O)OC)C>>ClC1=NN(C(=C1C)C=1C=C(SC1)C(=O)O)C
5
C(#N)C1=CC(=C(C(=O)OC)C=C1)O>C1CCCO1.Cl.[BH4-].[Li+]>OCC1=CC(=C(C#N)C=C1)O
3
BrC1=C(C(=CC=C1OC)[N+](=O)[O-])NC1=CC=CC=C1>>BrC1=C(C(=CC=C1OC)N)NC1=CC=CC=C1
5
N1CCC1.C(C)(C)(C)OC(=O)N1CC2C(C1)O2>O>N1(CCC1)C1CN(CC1O)C(=O)OC(C)(C)C
3
ClC=1C=C2C=C(C(NC2=CC1OC)=O)[C@H](C)N[S@](=O)C(C)(C)C>CO[H].Cl.O1CCOCC1>Cl.N[C@@H](C)C=1C(NC2=CC(=C(C=C2C1)Cl)OC)=O
3
C(C)(C)(C)OC(=O)N1CC(C1)N1N=CC(=C1)C=1C=NC2=CC=C(C=C2C1)SC1=NN=C2N1N=C(C=C2)C>>N1CC(C1)N1N=CC(=C1)C=1C=NC2=CC=C(C=C2C1)SC1=NN=C2N1N=C(C=C2)C
5
BrCC1=C(C=CC(=C1)I)Cl>N(C)(C)C=O.C1(C=2C(C(N1)=O)=CC=CC2)=O.[K]>ClC1=C(CN2C(C=3C(C2=O)=CC=CC3)=O)C=C(C=C1)I
3
[OH:1][CH:2]1[CH2:5][N:4](C(OC(C)(C)C)=O)[CH2:3]1.[ClH:13].CO[CH:16]1[CH2:19]N[CH2:17]1>>[ClH:13].[CH:16]([O:1][CH:2]1[CH2:3][NH:4][CH2:5]1)([CH3:19])[CH3:17]
2
COC(=O)C1=CC=C2C=CNC(C2=C1)=O>O.CO[H].[OH-].[Na+]>O=C1NC=CC2=CC=C(C=C12)C(=O)O
3
BrC1=CC(=C(C(=C1)F)CC(=O)O)F>N(C)(C)C=O.CO[H].ClCCl.C(C(=O)Cl)(=O)Cl>BrC1=CC(=C(C(=C1)F)CC(=O)OC)F
3
C(C)N1C=C(C2=C1N=CNC2=O)I.FC(S(=O)(=O)OC(C(F)(F)F)C)(F)F>N(C)(C)C=O.C(=O)([O-])[O-].[Cs+].[Cs+]>C(C)N1C=C(C2=C1N=CN(C2=O)C(C(F)(F)F)C)I
3
BrC1=NC=C(N=C1)CC=1C=NC(=C(C1)C1=CC(=CC=C1)Cl)OC>>ClC=1C=C(C=CC1)C=1C=C(C=NC1OC)CC=1N=CC(=NC1)NCCO
5
S(Cl)(Cl)=O.[OH:5][C:6]1[CH:7]=[N:8][C:9]([C:12]2[CH:13]=[C:14]([CH:18]=[CH:19][CH:20]=2)[C:15]([OH:17])=[O:16])=[N:10][CH:11]=1.[CH3:21]O>>[OH:5][C:6]1[CH:11]=[N:10][C:9]([C:12]2[CH:13]=[C:14]([CH:18]=[CH:19][CH:20]=2)[C:15]([O:17][CH3:21])=[O:16])=[N:8][CH:7]=1
1
C(C1=CC=CC=C1)N1CC=2CCC(NC2CC1)=O>BrBr.C([O-])([O-])=O.[Na+].[Na+].C(C)(=O)O>C(C1=CC=CC=C1)N1CC=2C=CC(NC2CC1)=O
3
C(C)(C)(C)NC(COC1=CC(=CC=C1)B1OC(C(O1)(C)C)(C)C)=O.ClC1=NC2=CC=C(C=C2C(=N1)NC1CC=2C(=NNC2)C1)OCC>O1CCOCC1.C([O-])([O-])=O.[Na+].[Na+].c1ccc(cc1)[P](c2ccccc2)(c3ccccc3)[Pd]([P](c4ccccc4)(c5ccccc5)c6ccccc6)([P](c7ccccc7)(c8ccccc8)c9ccccc9)[P](c1ccccc1)(c1ccccc1)c1ccccc1>C(C)(C)(C)NC(COC1=CC(=CC=C1)C1=NC2=CC=C(C=C2C(=N1)NC1CC=2C(=NNC2)C1)OCC)=O
3
[NH2:1][C:2]1[CH:7]=[C:6]([Br:8])[CH:5]=[CH:4][C:3]=1[N:9]([CH3:13])[CH2:10][CH2:11]O.S(Cl)([Cl:16])=O>C(Cl)Cl.CN(C=O)C>[Br:8][C:6]1[CH:7]=[C:2]([NH2:1])[C:3]([N:9]([CH2:10][CH2:11][Cl:16])[CH3:13])=[CH:4][CH:5]=1
1
ClC=1C=C(C=CC1C(=O)N1CCN(CC1)C(=O)C1CCC1)NC1CN(C1)C1CCN(CC1)C(=O)OC(C)(C)C>Cl.O1CCOCC1>Cl.ClC1=C(C(=O)N2CCN(CC2)C(=O)C2CCC2)C=CC(=C1)NC1CN(C1)C1CCNCC1
3
FC(C1(N=N1)C1=CC=C(C(=O)O)C=C1)(F)F.NCCCOC1=CC(=C(C(=C1)F)C=1C(=NC=2N(C1N[C@H](C(F)(F)F)C)N=CN2)Cl)F>ClCCl.C(=O)(C=1NC=CN1)C=1NC=CN1>ClC1=NC=2N(C(=C1C1=C(C=C(OCCCNC(C3=CC=C(C=C3)C3(N=N3)C(F)(F)F)=O)C=C1F)F)N[C@H](C(F)(F)F)C)N=CN2
3
[NH2:1][C:2]1[CH:3]=[C:4]([CH:21]=[CH:22][C:23]=1[F:24])[O:5][C:6]1[N:11]=[C:10]2[S:12][C:13]([NH:15][C:16]([CH:18]3[CH2:20][CH2:19]3)=[O:17])=[N:14][C:9]2=[CH:8][CH:7]=1.[F:25][C:26]([F:38])([F:37])[C:27]1[CH:32]=[CH:31][C:30]([CH2:33][C:34](O)=[O:35])=[CH:29][CH:28]=1.F[P-](F)(F)(F)(F)F.N1(OC(N(C)C)=[N+](C)C)C2N=CC=CC=2N=N1>N1C=CC=CC=1.C(OCC)(=O)C>[F:24][C:23]1[CH:22]=[CH:21][C:4]([O:5][C:6]2[N:11]=[C:10]3[S:12][C:13]([NH:15][C:16]([CH:18]4[CH2:20][CH2:19]4)=[O:17])=[N:14][C:9]3=[CH:8][CH:7]=2)=[CH:3][C:2]=1[NH:1][C:34](=[O:35])[CH2:33][C:30]1[CH:29]=[CH:28][C:27]([C:26]([F:37])([F:25])[F:38])=[CH:32][CH:31]=1
1
CS(=O)(=O)N.C1(CC1)C=1C(=CC(=C(C(=O)O)C1)F)OCC1(CCC2(CC2)CC1)C>C1(=CC=NC=C1)N(C)C.ClCCl.Cl.C(C)N=C=NCCCN(C)C>C1(CC1)C=1C(=CC(=C(C(=O)NS(=O)(=O)C)C1)F)OCC1(CCC2(CC2)CC1)C
3
[NH:1]1[C:9]2[C:4](=[CH:5][CH:6]=[CH:7][CH:8]=2)[CH:3]=[C:2]1[C:10]([NH:12][C@H:13]1[C:17](=[O:18])[N:16]([C:19]2[CH:24]=[CH:23][CH:22]=[CH:21][CH:20]=2)[CH2:15][C@H:14]1[C:25]([O:27]C(C)(C)C)=[O:26])=[O:11]>FC(F)(F)C(O)=O>[NH:1]1[C:9]2[C:4](=[CH:5][CH:6]=[CH:7][CH:8]=2)[CH:3]=[C:2]1[C:10]([NH:12][C@H:13]1[C:17](=[O:18])[N:16]([C:19]2[CH:20]=[CH:21][CH:22]=[CH:23][CH:24]=2)[CH2:15][C@H:14]1[C:25]([OH:27])=[O:26])=[O:11]
1
N(=[N+]=[N-])CC=1C(=NC2=CC=CC=C2C1C(=O)N[C@@H](CC)C1=CC=CC=C1)C1=CC=CC=C1>CCO[H].Cl.[HH].[Pd]>NCC=1C(=NC2=CC=CC=C2C1C(=O)N[C@@H](CC)C1=CC=CC=C1)C1=CC=CC=C1
3
[Cl:1][C:2]1[CH:3]=[C:4]([OH:29])[CH:5]=[C:6]([Cl:28])[C:7]=1[O:8][CH2:9][CH2:10][CH2:11][O:12][C:13]1[CH:18]=[CH:17][C:16]([N:19]2[C:23]([S:24][CH:25]([CH3:27])[CH3:26])=[N:22][N:21]=[N:20]2)=[CH:15][CH:14]=1.[Cl:30][C:31](Cl)([Cl:35])[CH2:32][CH2:33]Cl.C(=O)([O-])[O-].[K+].[K+].[I-].[K+]>CC(C)=O>[Cl:28][C:6]1[CH:5]=[C:4]([O:29][CH2:33][CH:32]=[C:31]([Cl:35])[Cl:30])[CH:3]=[C:2]([Cl:1])[C:7]=1[O:8][CH2:9][CH2:10][CH2:11][O:12][C:13]1[CH:14]=[CH:15][C:16]([N:19]2[C:23]([S:24][CH:25]([CH3:27])[CH3:26])=[N:22][N:21]=[N:20]2)=[CH:17][CH:18]=1
1
FC1=C(C=CC=C1)C=1C(=C2C(=NC1)N(C=C2)S(=O)(=O)C2=CC=CC=C2)N2CCN(CC2)C(=O)OC(C)(C)C>C1CCCO1.CO[H].[OH-].[Li+]>FC1=C(C=CC=C1)C=1C(=C2C(=NC1)NC=C2)N2CCN(CC2)C(=O)OC(C)(C)C
3
[CH3:1][C:2]1[C:7]([CH3:8])=[CH:6][CH:5]=[CH:4][C:3]=1[CH:9]([C:11]1[NH:12][CH:13]=[CH:14][N:15]=1)[CH3:10].C(=O)([O-])[O-].[Cs+].[Cs+].[C:22]([O:26][CH2:27]Cl)(=[O:25])[CH2:23][CH3:24]>CC(C)=O>[C:22]([O:26][CH2:27][N:15]1[CH:14]=[CH:13][N:12]=[C:11]1[CH:9]([C:3]1[CH:4]=[CH:5][CH:6]=[C:7]([CH3:8])[C:2]=1[CH3:1])[CH3:10])(=[O:25])[CH2:23][CH3:24]
1
COC=1C=C2C=CNC2=CC1>N(C)(C)C=O.N12CCN(CC1)CC2>COC=1C=C2C=CN(C2=CC1)C
3
ClC=1C=C(COC=2C=C(N)C=CC2)C=CC1.ClC=1C=C(C=CC1)/C=C/S(=O)(=O)Cl>O.C1CCCO1.C([O-])([O-])=O.[Na+].[Na+]>ClC=1C=C(COC=2C=C(C=CC2)NS(=O)(=O)\C=C\C2=CC(=CC=C2)Cl)C=CC1
3
O1C=C(C2=C1C=CC=C2)C[C@@H](B2O[C@@]1([C@H](O2)C[C@H]2C([C@@H]1C2)(C)C)C)NC(CCl)=O.Cl.C(#N)C(C(=O)N(C1CCOCC1)CC)=CC1=CC=C2CCNCC2=C1>CC#N.O.C([O-])([O-])=O.[K+].[K+].C(C)(=O)OCC.[I-].[Na+]>O1C=C(C2=C1C=CC=C2)C[C@@H](B2O[C@@]1([C@H](O2)C[C@H]2C([C@@H]1C2)(C)C)C)NC(CN2CC1=CC(=CC=C1CC2)C=C(C(=O)N(C2CCOCC2)CC)C#N)=O
3
ClC=1C2=C(N=CN1)C=NC(=C2)Cl.CC=1C=C(N)C=CC1OC1=CC=2N(C=C1)C(=CN2)C>C(C)(C)O>ClC1=CC2=C(N=CN=C2NC2=CC(=C(C=C2)OC2=CC=3N(C=C2)C(=CN3)C)C)C=N1
3
OC1=C(C(CC(C1)C1=CC2=C(C=C1)OCO2)=O)C(CC)=O>O.[N+](=O)(O)[O-].C(C)(=O)OC(C)=O.C(C)(=O)O>OC1=C(C(CC(C1)C1=C(C=C2C(=C1)OCO2)[N+](=O)[O-])=O)C(CC)=O
3
[C:1]([N:5]1[CH:10]=[CH:9][C:8]([CH3:12])([CH3:11])[CH2:7][CH2:6]1)([CH3:4])([CH3:3])[CH3:2].[C:13]1([N:19]=[C:20]=[O:21])[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=1>C(Cl)Cl>[C:1]([N:5]1[CH2:6][CH2:7][C:8]([CH3:12])([CH3:11])[C:9]([C:20]([NH:19][C:13]2[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=2)=[O:21])=[CH:10]1)([CH3:4])([CH3:2])[CH3:3]
2
C(N(CC)CC)C.N1C2C(=NC=CC=2)N(O)N=1.C(Cl)CCl.Cl.[NH2:23][C@H:24]1[CH2:28][CH2:27][CH2:26][C@H:25]1[OH:29].[N:30]1[N:31]([C:35]2[CH:43]=[CH:42][CH:41]=[CH:40][C:36]=2[C:37](O)=[O:38])[N:32]=[CH:33][CH:34]=1>C(Cl)Cl>[OH:29][C@@H:25]1[CH2:26][CH2:27][CH2:28][C@@H:24]1[NH:23][C:37](=[O:38])[C:36]1[CH:40]=[CH:41][CH:42]=[CH:43][C:35]=1[N:31]1[N:32]=[CH:33][CH:34]=[N:30]1
1
BrC1=CC(=C(C=C1)[N+](=O)[O-])F.C(C1=CC=CC=C1)N(CCO)C>C1CCCO1.[H-].[Na+]>C(C1=CC=CC=C1)N(C)CCOC1=C(C=CC(=C1)Br)[N+](=O)[O-]
3
[Br:1][C:2]1[C:11]([Br:12])=[C:10](I)[C:9]2[N:14]=[C:15]([NH:16][CH2:17][CH2:18][NH:19]C(=O)OC(C)(C)C)[N:7]3[C:8]=2[C:3]=1[CH2:4][CH2:5][CH2:6]3.[Cu][C:28]#[N:29].[ClH:30]>C(#N)C.CO.O1CCOCC1>[ClH:30].[NH2:19][CH2:18][CH2:17][NH:16][C:15]1[N:7]2[C:8]3[C:3]([CH2:4][CH2:5][CH2:6]2)=[C:2]([Br:1])[C:11]([Br:12])=[C:10]([C:28]#[N:29])[C:9]=3[N:14]=1
2
[NH2:1][C:2]1[CH:9]=[C:8]([F:10])[C:7]([O:11][CH3:12])=[CH:6][C:3]=1[CH:4]=O.[CH2:13]([C@:15]1([OH:31])[C:27]2[CH:26]=[C:25]3[N:21]([CH2:22][CH2:23][C:24]3=O)[C:20](=[O:29])[C:19]=2[CH2:18][O:17][C:16]1=[O:30])[CH3:14].C1(C)C=CC(S(O)(=O)=O)=CC=1>C1(C)C=CC=CC=1>[CH2:13]([C@:15]1([OH:31])[C:27]2[CH:26]=[C:25]3[N:21]([CH2:22][C:23]4[C:24]3=[N:1][C:2]3[CH:9]=[C:8]([F:10])[C:7]([O:11][CH3:12])=[CH:6][C:3]=3[CH:4]=4)[C:20](=[O:29])[C:19]=2[CH2:18][O:17][C:16]1=[O:30])[CH3:14]
2
COCOC1=CC=C2C(C(C(OC2=C1)=O)(C)C1=CC=C(C=C1)OCOC)CC=C>C1CCCO1.[H-].[Al+3].[Li+].[H-].[H-].[H-]>OC1=C(C=CC(=C1)OCOC)C(C(CO)(C)C1=CC=C(C=C1)OCOC)CC=C
3
NC1=NNC=C1C#N.BrCC1=CC=C(CN2N=CC=C2)C=C1>>N1(N=CC=C1)CC1=CC=C(CN2N=C(C(=C2)C#N)N)C=C1
5
FC(C1=C(C=CC=C1)S)(F)F.C(C)(C)(C)OC(N(C(=O)OC(C)(C)C)C1=NC(=CN=C1Br)N1CCC(CC1)(C)NC(=O)OC(C)(C)C)=O>CN1C(CCC1)=O.CN1CCOCC1>NC1(CCN(CC1)C1=CN=C(C(=N1)N)SC1=C(C=CC=C1)C(F)(F)F)C
3
C(=O)([O-])[O-].[K+].[K+].Cl[C:8]1[CH:22]=[C:21]([Cl:23])[CH:20]=[CH:19][C:9]=1[C:10]([C:12]1[CH:13]=[N:14][N:15]([CH3:18])[C:16]=1[OH:17])=[O:11]>CN(C)C=O>[Cl:23][C:21]1[CH:20]=[CH:19][C:9]2[C:10](=[O:11])[C:12]3[CH:13]=[N:14][N:15]([CH3:18])[C:16]=3[O:17][C:8]=2[CH:22]=1
1
[Br:1][C:2]1[CH:3]=[CH:4][C:5]2[O:14][C:13]3[C:12](=[O:15])[NH:11][C:10]([C:16]4[CH:17]=[C:18]([CH:22]=[CH:23][CH:24]=4)[C:19](O)=[O:20])=[N:9][C:8]=3[C:6]=2[CH:7]=1.[CH:25]1([NH2:31])[CH2:30][CH2:29][CH2:28][CH2:27][CH2:26]1.Cl.CN(C)CCCN=C=NCC.C1C=CC2N(O)N=NC=2C=1.CN1CCOCC1>ClCCl>[Br:1][C:2]1[CH:3]=[CH:4][C:5]2[O:14][C:13]3[C:12](=[O:15])[NH:11][C:10]([C:16]4[CH:17]=[C:18]([CH:22]=[CH:23][CH:24]=4)[C:19]([NH:31][CH:25]4[CH2:30][CH2:29][CH2:28][CH2:27][CH2:26]4)=[O:20])=[N:9][C:8]=3[C:6]=2[CH:7]=1
2
C1(=CC=C(C=C1)S(=O)(=O)O)C.N[C@]1([C@@H](C1)C=C)C(=O)NS(=O)(=O)C1CC1.C(C)(C)(C)OC(=O)N[C@H](C(=O)N1[C@@H](C[C@H](C1)O)C(=O)O)[C@@H](CC(CCC=C)C)C>ClCCl.C(C)(C)N(C(C)C)CC.F[P-](F)(F)(F)(F)F.N1(N=NC2=C1N=CC=C2)OC(=[N+](C)C)N(C)C>C1(CC1)S(=O)(=O)NC(=O)[C@@]1([C@@H](C1)C=C)NC(=O)[C@H]1N(C[C@@H](C1)O)C([C@H]([C@@H](CC(CCC=C)C)C)NC(OC(C)(C)C)=O)=O
3
[CH:1]1([CH2:6][O:7][C:8]2[C:9]([NH:21][C:22]([NH2:24])=[S:23])=[N:10][CH:11]=[C:12]([O:14][C:15]3[CH:20]=[CH:19][CH:18]=[CH:17][CH:16]=3)[CH:13]=2)[CH2:5][CH2:4][CH2:3][CH2:2]1.Cl[CH2:26][CH:27]=O>CN(C=O)C>[CH:1]1([CH2:6][O:7][C:8]2[C:9]([NH:21][C:22]3[S:23][CH:26]=[CH:27][N:24]=3)=[N:10][CH:11]=[C:12]([O:14][C:15]3[CH:16]=[CH:17][CH:18]=[CH:19][CH:20]=3)[CH:13]=2)[CH2:2][CH2:3][CH2:4][CH2:5]1
1
C(C)(=O)C=1C=NN2C1N=C(C=C2N(CCC2=CN(C1=CC=CC=C21)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C=2C=NC=C(C2)F>O.CO[H].Cl.[OH-].[Na+]>FC=1C=C(C=NC1)C1=NC=2N(C(=C1)NCCC1=CNC3=CC=CC=C13)N=CC2C(C)=O
3
[N:1]1[C:8](Cl)=[N:7][C:5](Cl)=[N:4][C:2]=1[Cl:3].[CH3:10][C:11]1[CH:15]=[C:14]([CH3:16])[NH:13][N:12]=1>CC(C)=O.O>[Cl:3][C:2]1[N:1]=[C:8]([N:12]2[C:11]([CH3:10])=[CH:15][C:14]([CH3:16])=[N:13]2)[N:7]=[C:5]([N:12]2[C:11]([CH3:10])=[CH:15][C:14]([CH3:16])=[N:13]2)[N:4]=1
2
OC1=CC=C(C=C1)B(O)O.ClC=1SC(=CN1)CNC>O.C([O-])([O-])=O.[Na+].[Na+].COCCOC.c1ccc(cc1)[P](c2ccccc2)(c3ccccc3)[Pd]([P](c4ccccc4)(c5ccccc5)c6ccccc6)([P](c7ccccc7)(c8ccccc8)c9ccccc9)[P](c1ccccc1)(c1ccccc1)c1ccccc1>CNCC1=CN=C(S1)C1=CC=C(C=C1)O
3
C(C=C)(=O)Cl.C(#N)C[C@H]1CN(CCN1)C1=CC(=NC(=N1)C1=CC=C2C=NN(C2=C1)C)C(=O)NC1=CC(=CC2=CC=CC=C12)O>N(C)(C)C=O.C(C)(C)N(C(C)C)CC>C(#N)C[C@H]1CN(CCN1C(C=C)=O)C1=CC(=NC(=N1)C1=CC=C2C=NN(C2=C1)C)C(=O)NC1=CC(=CC2=CC=CC=C12)O
3
C(C)(C)(C)[Si](C)(C)Cl.BrC=1C=C(C=C(C1)C(F)(F)F)O>O.ClCCl.CCN(CC)CC>BrC=1C=C(O[Si](C)(C)C(C)(C)C)C=C(C1)C(F)(F)F
3
CO.C[O:4][C:5]([C:7]1[CH:12]=[CH:11][CH:10]=[CH:9][C:8]=1[NH:13][C:14]([C:16]1[CH:29]=[CH:28][C:27]2[O:26][C:25]3[CH2:24][CH2:23][CH2:22][CH2:21][C:20]=3[C:19](=[O:30])[C:18]=2[CH:17]=1)=[O:15])=[O:6].[OH-].[Na+]>O>[C:5]([C:7]1[CH:12]=[CH:11][CH:10]=[CH:9][C:8]=1[NH:13][C:14]([C:16]1[CH:29]=[CH:28][C:27]2[O:26][C:25]3[CH2:24][CH2:23][CH2:22][CH2:21][C:20]=3[C:19](=[O:30])[C:18]=2[CH:17]=1)=[O:15])([OH:6])=[O:4]
1
ClC1=C(C=CC(=C1)F)S(=O)(=O)Cl.O=C1N(C2=C(C=NC=C2)N1CC(=O)O)C1CCNCC1>O.C1CCCO1>ClC1=C(C=CC(=C1)F)S(=O)(=O)N1CCC(CC1)N1C(N(C=2C=NC=CC21)CC(=O)O)=O
3
[Na].[O:2]=[C:3]([C:10]1[CH:15]=[CH:14][C:13]([S:16]C(=O)N(C)C)=[CH:12][CH:11]=1)[CH2:4][CH2:5][C:6]([O:8][CH3:9])=[O:7].O.Cl>CO>[O:2]=[C:3]([C:10]1[CH:11]=[CH:12][C:13]([SH:16])=[CH:14][CH:15]=1)[CH2:4][CH2:5][C:6]([O:8][CH3:9])=[O:7]
1
[N+:1]([C:4]1[CH:5]=C(C(O)=O)[CH:7]=[C:8]([CH:12]=1)[C:9]([OH:11])=O)([O-:3])=[O:2].[C:16](Cl)(=O)[C:17]([Cl:19])=[O:18].C(Cl)[Cl:23]>CN(C)C=O>[N+:1]([C:4]1[CH:5]=[C:16]([C:17]([Cl:19])=[O:18])[CH:7]=[C:8]([CH:12]=1)[C:9]([Cl:23])=[O:11])([O-:3])=[O:2]
1
[N:1]1[CH:6]=[CH:5][CH:4]=[C:3]([C:7]2[N:8]=[N:9][N:10]([C:12]3[O:16][C:15]([C:17]([OH:19])=O)=[CH:14][CH:13]=3)[CH:11]=2)[CH:2]=1.C(Cl)(=O)C(Cl)=O.C[N:27](C)C=O>>[N:1]1[CH:6]=[CH:5][CH:4]=[C:3]([C:7]2[N:8]=[N:9][N:10]([C:12]3[O:16][C:15]([C:17]([NH2:27])=[O:19])=[CH:14][CH:13]=3)[CH:11]=2)[CH:2]=1
2
CO[C:3](=[O:12])[C:4]1[CH:9]=[C:8](Br)[C:7](Cl)=[N:6][CH:5]=1.[OH:13][CH2:14][CH:15]1[CH2:17][CH2:16]1.[F:18][C:19]([F:30])([F:29])[C:20]1[CH:25]=[CH:24][C:23](B(O)O)=[CH:22][CH:21]=1.[NH2:31][CH2:32][C@:33]([CH3:38])([CH:35]1[CH2:37][CH2:36]1)[OH:34]>>[CH:35]1([C@@:33]([OH:34])([CH3:38])[CH2:32][NH:31][C:3](=[O:12])[C:4]2[CH:9]=[C:8]([C:23]3[CH:24]=[CH:25][C:20]([C:19]([F:30])([F:29])[F:18])=[CH:21][CH:22]=3)[C:7]([O:13][CH2:14][CH:15]3[CH2:17][CH2:16]3)=[N:6][CH:5]=2)[CH2:37][CH2:36]1
1
[CH:1]([N:4](C(C)C)CC)(C)C.[CH3:10][N:11]1[CH2:15][CH2:14][CH2:13][C:12]1=O.[NH2:17][C:18]1[N:23]=[CH:22][C:21]([C:24]2[N:32]=[C:31]3[C:27]([N:28]=[C:29](Cl)[N:30]3[CH2:33][C:34]([F:37])([F:36])[F:35])=[C:26]([N:39]3[CH2:44][CH2:43][O:42][CH2:41][CH2:40]3)[N:25]=2)=[CH:20][N:19]=1>O>[CH2:14]([C@H:13]1[NH:4][CH2:1][CH2:10][N:11]([C:29]2[N:30]([CH2:33][C:34]([F:35])([F:37])[F:36])[C:31]3[C:27]([N:28]=2)=[C:26]([N:39]2[CH2:40][CH2:41][O:42][CH2:43][CH2:44]2)[N:25]=[C:24]([C:21]2[CH:22]=[N:23][C:18]([NH2:17])=[N:19][CH:20]=2)[N:32]=3)[CH2:12]1)[CH3:15]
1
C(#N)[C@H](C[C@H]1C(NCC1)=O)NC(=O)[C@@H]1CCC2=CC=C(C(N12)=O)NCC(=O)OC1=CC=CC=C1>O.C1CCCO1.CO[H].Cl.O[Li].O>C(#N)[C@H](C[C@H]1C(NCC1)=O)NC(=O)[C@@H]1CCC2=CC=C(C(N12)=O)NCC(=O)O
3
C(C)(C)(C)OC(=O)N1C(=CC2=C(C=CC=C12)OCCN(C)C(=O)OC(C)(C)C)S(=O)(=O)C1=CC=CC=C1>CCO[H].Cl>Cl.C1(=CC=CC=C1)S(=O)(=O)C=1NC2=CC=CC(=C2C1)OCCNC
3