Input: N,N,11,20-tetraphenyl-9-oxa-11-aza-1-borahexacyclo[10.10.1.02,10.03,8.016,23.017,22]tricosa-2(10),3,5,7,12,14,16(23),17(22),18,20-decaen-14-amine

Output: C1=CC=C(C2=CC=C3C(=C2)B2C4=C3C=C(N(C3=CC=CC=C3)C3=CC=CC=C3)C=C4N(C3=CC=CC=C3)C3=C2C2=CC=CC=C2O3)C=C1


Input: 5,8-di(propan-2-yl)-3-oxa-4-azatricyclo[5.2.1.02,6]dec-4-ene


Input: [3-[(Z)-heptadec-9-enoyl]oxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropyl] (12Z,15Z,18Z,21Z,24Z,27Z,30Z,33Z)-hexatriaconta-12,15,18,21,24,27,30,33-octaenoate

Output: CCC=CCC=CCC=CCC=CCC=CCC=CCC=CCC=CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCC)OC(=O)CCCCC=CCC=CCC=CCC=CCC


Output: CCC=CCC=CCC=CCC=CCC=CCC=CCCCCCCCCCCCCCCC(=O)OCC(O)COP(=O)(O)OCC(O)COP(=O)(O)OCC(COC(=O)CCCCCCCCCCCCCCCCCC=CCC=CCC=CCC=CCC=CCC)OC(=O)CCCCCCCCC=CCC=CCC=CCCCCC


Input: methyl 2-[1-(2-chlorophenyl)indol-4-yl]acetate

Output: COC(=O)CC1=CC=CC2=C1C=CN2C1=CC=CC=C1Cl


Input: 3-(2-methyl-2-propan-2-yloxypropoxy)azetidine


Input: 2-[5-cyclobutyl-1-(3-hydroxy-2,2-dimethylpropyl)triazol-4-yl]acetonitrile


Input: 5-(2-chloropyridin-3-yl)-1H-pyrazol-4-amine


Input: 2-[1-(2-chloro-6-methylpyridin-4-yl)cyclopropyl]-2-hydroxyacetic acid

Output: CC1=CC(C2(C(O)C(=O)O)CC2)=CC(Cl)=N1


Input: methyl 5-(2-aminoacetyl)-2-methylfuran-3-carboxylate

Output: COC(=O)C1=C(C)OC(C(=O)CN)=C1


Input: tert-butyl N-(1-hydroxy-3-piperidin-1-ylpropan-2-yl)carbamate

Output: CC(C)(C)OC(=O)NC(CO)CN1CCCCC1


Input: (1,3-dioxoisoindol-2-yl) 6,7-dihydro-4H-thieno[3,2-c]thiopyran-4-carboxylate

Output: O=C(ON1C(=O)C2=CC=CC=C2C1=O)C1SCCC2=C1C=CS2


Input: (4-chloro-2-oxabicyclo[2.1.1]hexan-1-yl)methanol


Input: 5-(3-fluoro-2-hydroxypropyl)pyrazolo[1,5-a]pyrazin-4-one


Input: 5-[3-(dimethylamino)propyl-methylamino]-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-oxopentanoic acid

Output: CN(C)CCCN(C)C(=O)C(CCC(=O)O)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C21


Input: ethyl (2S,3R)-2-cyclopropylpyrrolidine-3-carboxylate

Output: CCOC(=O)C1CCNC1C1CC1


Input: 10-(2,6-dimethylphenyl)-5-[2-[2-[3-[3-(trideuteriomethyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-id-9-yl]pyridin-4-yl]benzo[b][1,4]benzazaborinine;platinum

Output: CC1=CC=CC(C)=C1B1C2=CC=CC=C2N(C2=CC=NC(N3C4=[C-]C(OC5=[C-]C(N6[C-]=[N+](C)C7=CC=CC=C76)=CC=C5)=CC=C4C4=CC=CC=C43)=C2)C2=CC=CC=C12;[Pt]


Input: methyl (2S,3R)-2-ethyl-3-(hydroxymethyl)-4-(3-methylimidazol-4-yl)butanoate

Output: CCC(C(=O)OC)C(CO)CC1=CN=CN1C


Input: 4-hydroxy-N-(1H-indol-7-ylmethyl)thiophene-2-carboxamide


Input: 1-(2,2-dimethyl-1,3-dihydroindol-3-yl)-3-[1-(1,3-thiazol-2-yl)pyrazol-4-yl]urea

Output: CC1(C)NC2=CC=CC=C2C1NC(=O)NC1=CN(C2=NC=CS2)N=C1


Input: N-(3-benzamidocyclobutyl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide

Output: O=C(NC1CC(NC(=O)C2=NNC(C3=CC=CO3)=C2)C1)C1=CC=CC=C1


Input: N-[4-[3-(5-bromopyrimidin-2-yl)piperidine-1-carbonyl]phenyl]-N-methylprop-2-enamide

Output: C=CC(=O)N(C)C1=CC=C(C(=O)N2CCCC(C3=NC=C(Br)C=N3)C2)C=C1


Input: N-[3-(cyanomethyl)phenyl]-N-[[2-(methoxymethyl)pyrazol-3-yl]methyl]prop-2-enamide

Output: C=CC(=O)N(CC1=CC=NN1COC)C1=CC=CC(CC#N)=C1


Input: 3-chloro-8-[(1-methylpyrazol-4-yl)methoxy]-5-prop-1-en-2-ylisoquinoline

Output: C=C(C)C1=CC=C(OCC2=CN(C)N=C2)C2=CN=C(Cl)C=C12


Input: 7,8-bis[(4-carboxy-2,5-dihydroxybenzoyl)amino]bicyclo[2.2.2]octa-1,3,5-triene-2-carboxylic acid

Output: O=C(O)C1=CC(O)=C(C(=O)NC2C3=CC=C(C(C(=O)O)=C3)C2NC(=O)C2=CC(O)=C(C(=O)O)C=C2O)C=C1O


Input: 2-(3-methylbut-1-en-2-yl)imidazo[1,2-a]pyridine


Input: 4-(1-fluoroethyl)-N-[(4-fluorophenyl)methyl]-5-(3-methyl-1,2-oxazol-5-yl)pyrimidin-2-amine

Output: CC1=NOC(C2=CN=C(NCC3=CC=C(F)C=C3)N=C2C(C)F)=C1


Input: 7'-(4-ethyl-N-(4-ethylphenyl)anilino)-2'-[(E)-2-(4-ethyl-N-(4-ethylphenyl)anilino)prop-1-enyl]-3'-methylspiro[2-benzofuran-3,4'-chromene]-1-one

Output: CCC1=CC=C(N(C(C)=CC2=C(C)C3(OC(=O)C4=CC=CC=C43)C3=CC=C(N(C4=CC=C(CC)C=C4)C4=CC=C(CC)C=C4)C=C3O2)C2=CC=C(CC)C=C2)C=C1


Input: 5-cyclopent-2-en-1-ylidene-3-phenylcyclohept-3-en-1-imine

Output: N=C1[CH-]C(C2=CC=CC=C2)=CC(=C2C=C[CH+]C2)[CH+]C1


Input: 2-(difluoromethoxy)-6-(2-methylbutan-2-yl)pyridine


Input: 11-dibenzothiophen-3-yl-8-(7,9-diphenylcarbazol-3-yl)benzo[a]carbazole

Output: C1=CC=C(C2=CC=C3C4=CC(C5=CC=C6C(=C5)C5=CC=C7C=CC=CC7=C5N6C5=CC=C6C(=C5)SC5=CC=CC=C56)=CC=C4N(C4=CC=CC=C4)C3=C2)C=C1


Input: iridium;2-[7-methyl-1-(trideuteriomethyl)-3H-dibenzofuran-3-id-4-yl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazole;trimethyl-[6-[4-(trideuteriomethyl)benzene-6-id-1-yl]pyridin-3-yl]germane

Output: CC1=CC=C2C(=C1)OC1=C(C3=NC4=CC=CC=C4N3C3=C(C(C)C)C=C(C4=CC=CC=C4)C=C3C(C)C)[C-]=CC(C)=C12;CC1=C[C-]=C(C2=CC=C([Ge](C)(C)C)C=N2)C=C1;[Ir]


Input: 5-[(3R)-3-(5-amino-7-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)piperidin-1-yl]-1-propan-2-ylpyridin-2-one

Output: COC1=CC=CC2=C1N=C(N)N1N=C(C3CCCN(C4=CN(C(C)C)C(=O)C=C4)C3)N=C21


Input: (2R)-N-[(4-cyclohexylpyridin-2-yl)methyl]-N-(1-oxo-2H-phthalazin-6-yl)-1-(2,3,5,6-tetrafluoro-4-methylphenyl)sulfonylazetidine-2-carboxamide

Output: CC1=C(F)C(F)=C(S(=O)(=O)N2CCC2C(=O)N(CC2=CC(C3CCCCC3)=CC=N2)C2=CC=C3C(=O)NN=CC3=C2)C(F)=C1F


Input: 1-[(2,4-dichlorophenyl)methyl]-N-(5-fluoro-2-oxo-3H-1,3-benzoxazol-6-yl)triazole-4-carboxamide

Output: O=C(NC1=CC2=C(C=C1F)NC(=O)O2)C1=CN(CC2=CC=C(Cl)C=C2Cl)N=N1


Input: 1-[(1-acetylpyrrolidin-3-yl)methyl]-1-methyl-3-(5-phenoxypyrimidin-2-yl)urea

Output: CC(=O)N1CCC(CN(C)C(=O)NC2=NC=C(OC3=CC=CC=C3)C=N2)C1


Input: N-[2-[5,6-dihydro-4H-cyclopenta[c]furan-3-carbonyl(methyl)amino]ethylsulfonyl]-5,6-dihydro-4H-cyclopenta[c]furan-3-carboxamide

Output: CN(CCS(=O)(=O)NC(=O)C1=C2CCCC2=CO1)C(=O)C1=C2CCCC2=CO1


Input: 1-[3-[(3,5-difluorophenyl)methyl]pyrrolidin-1-yl]-3-(3-hydroxyphenyl)propan-1-one

Output: O=C(CCC1=CC=CC(O)=C1)N1CCC(CC2=CC(F)=CC(F)=C2)C1


Input: 1-[(3aS,4R,6aR)-4-phenyl-2-(quinoline-8-carbonyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]ethanone

Output: CC(=O)N1CC2CN(C(=O)C3=CC=CC4=CC=CN=C34)CC2C1C1=CC=CC=C1


Input: 1-[(3aS,4R,6aR)-2-(4-hydroxycyclohexanecarbonyl)-4-(4-methoxyphenyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]ethanone

Output: COC1=CC=C(C2C3CN(C(=O)C4CCC(O)CC4)CC3CN2C(C)=O)C=C1


Input: tert-butyl N-[(3S)-1-benzyl-3-(3,3-dicyano-2-phenylprop-2-enyl)-2-oxoindol-3-yl]carbamate

Output: CC(C)(C)OC(=O)NC1(CC(=C(C#N)C#N)C2=CC=CC=C2)C(=O)N(CC2=CC=CC=C2)C2=CC=CC=C21


Input: 5-[8-(2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)naphthalen-1-yl]-2,3-dihydrothieno[3,4-b][1,4]dioxine

Output: C1=CC(C2=C3OCCOC3=CS2)=C2C(C3=C4OCCOC4=CS3)=CC=CC2=C1


Input: N-(3-naphthalen-1-ylphenyl)-9-phenyl-N-[4-(3-triphenylsilylphenyl)phenyl]carbazol-4-amine

Output: C1=CC=C(N2C3=CC=CC=C3C3=C(N(C4=CC=C(C5=CC=CC([Si](C6=CC=CC=C6)(C6=CC=CC=C6)C6=CC=CC=C6)=C5)C=C4)C4=CC=CC(C5=CC=CC6=CC=CC=C56)=C4)C=CC=C32)C=C1


Input: 2-ethoxy-N-[[(1R,8R,9S)-6-oxo-11-(2H-triazole-4-carbonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-8-yl]methyl]acetamide

Output: CCOCC(=O)NCC1C2CC(CN(C(=O)C3=NNN=C3)C2)C2=CC=CC(=O)N21


Input: 4-bromo-1-(2-methoxyethyl)indole-3-carbaldehyde


Input: 3-(2-benzoylanilino)-1-(2-hydroxyethyl)pyrrole-2,5-dione

Output: O=C(C1=CC=CC=C1)C1=CC=CC=C1NC1=CC(=O)N(CCO)C1=O