SMILES
stringlengths 2
724
| IUPAC
stringlengths 6
1.34k
|
|---|---|
CCc1ccc(CBr)c(C)c1
|
1-(bromomethyl)-4-ethyl-2-methylbenzene
|
CCC(C)CCC(=O)O
|
4-methylhexanoicacid
|
CCCNc1cc(C(=O)NC2CC2)ccc1C
|
N-cyclopropyl-4-methyl-3-(propylamino)benzamide
|
CCCCCN(Br)CCC
|
N-bromo-N-propylpentan-1-amine
|
CC1=CCC=CC1
|
1-methylcyclohexa-1,4-diene
|
O=C(F)NCBr
|
N-(bromomethyl)carbamoylfluoride
|
NCc1c(SI)oc2ccccc12
|
[3-(aminomethyl)-1-benzofuran-2-yl]thiohypoiodite
|
N#CCCNCBr
|
3-(bromomethylamino)propanenitrile
|
FCNCF
|
fluoroN-(fluoromethyl)methanamine
|
ClCCSI
|
2-chloroethylthiohypoiodite
|
FCC(F)NCCBr
|
N-(2-bromoethyl)-1,2-difluoroethanamine
|
Cc1cccc(CSCO)c1
|
(3-methylphenyl)methylsulfanylmethanol
|
FCCSI
|
2-fluoroethylthiohypoiodite
|
CCCN(C#CCCSSC)C(F)(I)C#N
|
2-fluoro-2-iodo-2-[4-(methyldisulfanyl)but-1-ynyl-propylamino]acetonitrile
|
CSCC(F)NS
|
N-(1-fluoro-2-methylsulfanylethyl)thiohydroxylamine
|
COCN(O)F
|
N-fluoro-N-(methoxymethyl)hydroxylamine
|
ON(F)SCCCl
|
N-(2-chloroethylsulfanyl)-N-fluorohydroxylamine
|
CCCSCNCS
|
propylsulfanylmethylaminomethanethiol
|
FN=NCCl
|
chloromethyl(fluoro)diazene
|
CCCCCC#N
|
hexanenitrile
|
Cc1ccc(F)cc1
|
1-fluoro-4-methylbenzene
|
O=CCS
|
2-sulfanylacetaldehyde
|
COOc1ccc(I)cc1
|
1-iodo-4-methylperoxybenzene
|
CN(O)F
|
N-fluoro-N-methylhydroxylamine
|
[N-]=[N+]=NCS
|
azidomethanethiol
|
O=CCCCBr
|
4-bromobutanal
|
O=C(O)CCOC(=O)O
|
3-carboxyoxypropanoicacid
|
SC=Cc1ccccc1
|
2-phenylethenethiol
|
CCOC(=O)CCCCCCNCc1ccc(S)c(F)c1
|
ethyl7-[(3-fluoro-4-sulfanylphenyl)methylamino]heptanoate
|
O=C(O)Nc1n[nH]c2cc(F)ncc12
|
(6-fluoro-1H-pyrazolo[4,3-c]pyridin-3-yl)carbamicacid
|
CCC(C=O)CBr
|
2-(bromomethyl)butanal
|
FNc1ccc(S)c(F)c1
|
2-fluoro-4-(fluoroamino)benzenethiol
|
CSCSCS
|
methylsulfanylmethylsulfanylmethanethiol
|
Cc1ccc(I)cc1
|
1-iodo-4-methylbenzene
|
C=C(Cl)SC
|
1-chloro-1-methylsulfanylethene
|
CCSCCI
|
1-ethylsulfanyl-2-iodoethane
|
CCCCN(C)CCOC
|
N-(2-methoxyethyl)-N-methylbutan-1-amine
|
OCN(F)S
|
[fluoro(sulfanyl)amino]methanol
|
CC(S)(CS)C1CC1
|
2-cyclopropylpropane-1,2-dithiol
|
C#COC(=O)CCCCCCNC(NCC)NCF
|
ethynyl7-[[ethylamino-(fluoromethylamino)methyl]amino]heptanoate
|
N#CSN=CCCCCl
|
4-chlorobutylideneaminothiocyanate
|
CCC=Cc1cc(C)ccc1OC(C)C#N
|
2-(2-but-1-enyl-4-methylphenoxy)propanenitrile
|
OOCSF
|
hydroperoxymethylthiohypofluorite
|
CCS(=O)CCCF
|
1-ethylsulfinyl-3-fluoropropane
|
Cc1ccc(OC(C)C#N)c(SCF)c1
|
2-[2-(fluoromethylsulfanyl)-4-methylphenoxy]propanenitrile
|
NCSSF
|
fluorodisulfanylmethanamine
|
CN(CF)CCl
|
N-(chloromethyl)-N-(fluoromethyl)methanamine
|
O=C(C=CO)NO
|
3-hydroxy-N-hydroxyprop-2-enamide
|
N=CSC=S
|
methanimidoylsulfanylmethanethioaldehyde
|
CSSOC#N
|
methyldisulfanylcyanate
|
CN(CF)C(=O)O
|
fluoromethyl(methyl)carbamicacid
|
COCC(F)C(=O)F
|
2-fluoro-3-methoxypropanoylfluoride
|
CCN(S)Br
|
N-bromo-N-ethylthiohydroxylamine
|
CN(F)Cc1ccc(CI)cc1
|
N-fluoro-N-[[4-(iodomethyl)phenyl]methyl]methanamine
|
Fc1ccc(CI)c(SCBr)c1
|
2-(bromomethylsulfanyl)-4-fluoro-1-(iodomethyl)benzene
|
CCS(=O)CC(C)=O
|
1-ethylsulfinylpropan-2-one-
|
CN=CI
|
iodoN-methylmethanimine
|
CC(CCC1CO1)(COI)C1CC1
|
[2-cyclopropyl-2-methyl-4-(oxiran-2-yl)butyl]hypoiodite
|
COC(C)(C)OC(=O)N(C)Cc1ncccc1Cl
|
2-methoxypropan-2-ylN-[(3-chloropyridin-2-yl)methyl]-N-methylcarbamate
|
COC(=O)CSC
|
methyl2-methylsulfanylacetate
|
N#COCCl
|
chloromethoxyformonitrile
|
CN(F)CO
|
[fluoro(methyl)amino]methanol
|
CC#CSS
|
1-(disulfanyl)prop-1-yne
|
CCCN(F)CBr
|
N-(bromomethyl)-N-fluoropropan-1-amine
|
C#CNC#N
|
ethynylcyanamide
|
CC(=O)CCc1cc(O)cc(SNC(C)=O)c1
|
N-[3-hydroxy-5-(3-oxobutyl)phenyl]sulfanylacetamide
|
NCSCI
|
iodomethylsulfanylmethanamine
|
N#CONI
|
iodoaminocyanate
|
Cc1cc(F)ccc1Cl
|
1-chloro-4-fluoro-2-methylbenzene
|
CCC(C)F
|
2-fluorobutane
|
N=C1C(CNO)C1NF
|
N-[[2-(fluoroamino)-3-iminocyclopropyl]methyl]hydroxylamine
|
O=Cc1cc(F)cc(CS)c1
|
3-fluoro-5-(sulfanylmethyl)benzaldehyde
|
N#CCN(F)CF
|
2-[fluoro(fluoromethyl)amino]acetonitrile
|
N#CC=CC=CC=COC[N+](=O)[O-]
|
7-(nitromethoxy)hepta-2,4,6-trienenitrile
|
N#CCC(F)(F)I
|
3,3-difluoro-3-iodopropanenitrile
|
Cc1ccc(OC(F)(F)F)cc1
|
1-methyl-4-(trifluoromethoxy)benzene
|
CCCC(NO)NBr
|
N-[1-(bromoamino)butyl]hydroxylamine
|
CC(CO)SCC(=O)OCS
|
sulfanylmethyl2-(1-hydroxypropan-2-ylsulfanyl)acetate
|
CN(F)NCS
|
[[fluoro(methyl)amino]amino]methanethiol
|
ICCSI
|
2-iodoethylthiohypoiodite
|
FCC(S)Cl
|
1-chloro-2-fluoroethanethiol
|
C=C(S)SI
|
1-sulfanylethenylthiohypoiodite
|
CCC=CC#N
|
pent-2-enenitrile
|
NC(F)SI
|
[amino(fluoro)methyl]thiohypoiodite
|
CCCCC(CCCI)B(C)O
|
1-iodooctan-4-yl(methyl)borinicacid
|
C=C(F)C#N
|
2-fluoroprop-2-enenitrile
|
CC=CSCS
|
prop-1-enylsulfanylmethanethiol
|
CNC(=O)NF
|
1-fluoro-3-methylurea
|
CSCC#CN(C)N=O
|
N-methyl-N-(3-methylsulfanylprop-1-ynyl)nitrousamide
|
CC(=O)CSc1ccccc1F
|
1-(2-fluorophenyl)sulfanylpropan-2-one
|
CC(F)COF
|
2-fluoropropylhypofluorite
|
CSCCNN
|
2-methylsulfanylethylhydrazine
|
NS(=O)(=O)F
|
sulfamoylfluoride
|
SNCBr
|
N-(bromomethyl)thiohydroxylamine
|
CSCCCCI
|
1-iodo-4-methylsulfanylbutane
|
N#CNCI
|
iodomethylcyanamide
|
Cc1ccc(C)c(I)c1
|
2-iodo-1,4-dimethylbenzene
|
COC#CNC#N
|
2-methoxyethynylcyanamide
|
COCOC#CBr
|
1-bromo-2-(methoxymethoxy)ethyne
|
CN(O)CO
|
[hydroxy(methyl)amino]methanol
|
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