SMILES
stringlengths 2
789
| IUPAC
stringlengths 6
2.54k
|
|---|---|
N#COC#CS
|
2-sulfanylethynylcyanate
|
CC(N)NC(=O)O
|
1-aminoethylcarbamicacid
|
CCC(C)C(S)CS
|
3-methylpentane-1,2-dithiol
|
CCSOCCCN(CO)CC1COCCC1NC
|
[3-ethylsulfanyloxypropyl-[[4-(methylamino)oxan-3-yl]methyl]amino]methanol
|
CC(=O)OCC1CC2OC2CN1CCCN
|
[3-(3-aminopropyl)-7-oxa-3-azabicyclo[4.1.0]heptan-4-yl]methylacetate
|
CC(C)(C)OCOC=N
|
(2-methylpropan-2-yl)oxymethylmethanimidate
|
CN1CC1
|
1-methylaziridine
|
CC(F)SCF
|
1-fluoro-1-(fluoromethylsulfanyl)ethane
|
CC=NCC
|
N-ethylethanimine
|
C=CC(=C)F
|
2-fluorobuta-1,3-diene
|
C=CCCN1CCC(NC2CC(C)=NC(COC)=N2)CC1
|
N-(1-but-3-enylpiperidin-4-yl)-2-(methoxymethyl)-6-methyl-4,5-dihydropyrimidin-4-amine
|
O=C(NS)c1ccccc1
|
N-sulfanylbenzamide
|
N=Cc1cccc(CO)c1
|
(3-methanimidoylphenyl)methanol
|
SCNCBr
|
bromomethylaminomethanethiol
|
CC(C)COCCS
|
2-(2-methylpropoxy)ethanethiol
|
CS(=O)CCO
|
2-methylsulfinylethanol
|
CC(Br)SCF
|
1-bromo-1-(fluoromethylsulfanyl)ethane
|
S=COCS
|
methanethioyloxymethanethiol
|
C#CC(=O)CO
|
1-hydroxybut-3-yn-2-one-
|
C#CN(O)NC
|
N-ethynyl-N-(methylamino)hydroxylamine
|
OCNCCCCF
|
4-fluorobutylaminomethanol
|
CCC(C)(C)OCOC
|
2-(methoxymethoxy)-2-methylbutane
|
O=S(CCO)NS
|
2-hydroxy-N-sulfanylethanesulfinamide
|
C#CCCOO
|
1-hydroperoxybut-3-yne
|
C=CC=N
|
prop-2-en-1-imine
|
C=C(O)OO
|
1-hydroperoxyethenol
|
CC(C)C(N)Br
|
1-bromo-2-methylpropan-1-amine
|
CNC=C(C)F
|
2-fluoro-N-methylprop-1-en-1-amine
|
N=C(O)F
|
fluoromethanimidicacid
|
O=CN=O
|
nitrosoformaldehyde
|
COCCOC#N
|
2-methoxyethylcyanate
|
Nc1ccccc1O
|
2-aminophenol
|
NNc1cccc(NF)c1
|
N-fluoro-3-hydrazinylaniline
|
CC#CCCF
|
1-fluoropent-3-yne
|
CC(S)OCCBr
|
1-(2-bromoethoxy)ethanethiol
|
CN(S)Br
|
N-bromo-N-methylthiohydroxylamine
|
C#CC(C)F
|
3-fluorobut-1-yne
|
O=Nc1ccccc1SCCO
|
2-(2-nitrosophenyl)sulfanylethanol
|
NNCCCCF
|
4-fluorobutylhydrazine
|
NCCOCC=O
|
2-(2-aminoethoxy)acetaldehyde
|
SCC=Cc1ccccc1
|
3-phenylprop-2-ene-1-thiol
|
COCNO
|
N-(methoxymethyl)hydroxylamine
|
O=CSF
|
formylthiohypofluorite
|
SCCCl
|
2-chloroethanethiol
|
OCC=NCF
|
2-(fluoromethylimino)ethanol
|
NC(O)F
|
amino(fluoro)methanol
|
N=Cc1cccc(F)c1
|
(3-fluorophenyl)methanimine
|
COCCC=O
|
3-methoxypropanal
|
OOCCCC=S
|
4-hydroperoxybutanethial
|
CCc1cccc(C=N)c1
|
(3-ethylphenyl)methanimine
|
C=C(S)Br
|
1-bromoethenethiol
|
C#CC(=O)F
|
prop-2-ynoylfluoride
|
N#CCNN
|
2-hydrazinylacetonitrile
|
Nc1ccc(Br)cc1Oc1ccc(F)c(F)c1
|
4-bromo-2-(3,4-difluorophenoxy)aniline
|
CC(CF)CSS
|
1-(disulfanyl)-3-fluoro-2-methylpropane
|
C#CC=S
|
prop-2-ynethial
|
CC=C(OC)C(Br)CCCC=NBr
|
N-bromo-5-bromo-6-methoxyoct-6-en-1-imine
|
CC(C#N)COCCS
|
2-methyl-3-(2-sulfanylethoxy)propanenitrile
|
CN=CCF
|
2-fluoro-N-methylethanimine
|
CC=CNC(C)=O
|
N-prop-1-enylacetamide
|
CP(CO)CC=CNC(=O)CO
|
2-hydroxy-N-[3-[hydroxymethyl(methyl)phosphanyl]prop-1-enyl]acetamide
|
CCCCCNN
|
pentylhydrazine
|
[N-]=[N+]=NO
|
N-diazohydroxylamine
|
COc1cc(F)ccc1N
|
4-fluoro-2-methoxyaniline
|
COC(Cl)CF
|
1-chloro-2-fluoro-1-methoxyethane
|
C=CC(C)NCCO
|
2-(but-3-en-2-ylamino)ethanol
|
O=C(CCl)Nc1ccccn1
|
2-chloro-N-pyridin-2-ylacetamide
|
C=CC(O)Cl
|
1-chloroprop-2-en-1-ol
|
FN=CCCl
|
2-chloro-N-fluoroethanimine
|
CN=CCl
|
chloroN-methylmethanimine
|
O=C(O)c1cc(S)ccc1OCC1CC1
|
2-(cyclopropylmethoxy)-5-sulfanylbenzoicacid
|
CNN(O)CSS
|
N-(disulfanylmethyl)-N-(methylamino)hydroxylamine
|
NNNN
|
hydrazinylhydrazine
|
CCC(N)F
|
1-fluoropropan-1-amine
|
C=CCOCN(C)CF
|
N-(fluoromethyl)-N-methyl-1-prop-2-enoxymethanamine
|
CONC=NOC1CC2CNCC21
|
N'-(3-azabicyclo[3.2.0]heptan-6-yloxy)-N-methoxymethanimidamide
|
NC=NCF
|
N'-(fluoromethyl)methanimidamide
|
CONCO
|
methoxyaminomethanol
|
SNN1CCCC1
|
pyrrolidin-1-ylthiohydroxylamine
|
CC=C(C)N=O
|
2-nitrosobut-2-ene
|
COCOC(C)(C)CS
|
2-(methoxymethoxy)-2-methylpropane-1-thiol
|
FCCNBr
|
N-bromo-2-fluoroethanamine
|
CCC=CNN
|
but-1-enylhydrazine
|
COCCCCO
|
4-methoxybutan-1-ol
|
CN(N)S
|
N-amino-N-methylthiohydroxylamine
|
FCCCCS
|
4-fluorobutane-1-thiol
|
CN=CCOF
|
2-methyliminoethylhypofluorite
|
C[N+](Br)(CCl)NN=O
|
bromo-(chloromethyl)-methyl-(nitrosoamino)azanium
|
CC(=O)C(N)c1cccc(N)c1
|
1-amino-1-(3-aminophenyl)propan-2-one
|
C=C(C)NN
|
prop-1-en-2-ylhydrazine
|
FCCCCNF
|
N-fluoro-4-fluorobutan-1-amine
|
CN=CSS
|
disulfanylN-methylmethanimine
|
N=CCOCF
|
2-(fluoromethoxy)ethanimine
|
CCCN=O
|
1-nitrosopropane
|
CS(=O)F
|
methanesulfinylfluoride
|
CCN(O)Br
|
N-bromo-N-ethylhydroxylamine
|
O=C(O)CCS
|
3-sulfanylpropanoicacid
|
FC=CCNF
|
N-fluoro-3-fluoroprop-2-en-1-amine
|
CCc1cccc(C)c1
|
1-ethyl-3-methylbenzene
|
N#CC(=N)O
|
cyanomethanimidicacid
|
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