SMILES
stringlengths
2
1.01k
IUPAC
stringlengths
6
1.31k
N=C1CC1F
2-fluorocyclopropan-1-imine
COCC(O)Cl
1-chloro-2-methoxyethanol
C=C(C)CC=CC(N)=O
5-methylhexa-2,5-dienamide
N=CCSS
2-(disulfanyl)ethanimine
N#CCCCO
4-hydroxybutanenitrile
CC(=N)SS
disulfanylethanimine
CSCC=NS
2-methylsulfanyl-N-sulfanylethanimine
COC(C)N
1-methoxyethanamine
SNC(I)CI
N-(1,2-diiodoethyl)thiohydroxylamine
FCSC=S
fluoromethylsulfanylmethanethioaldehyde
CC(O)COF
2-hydroxypropylhypofluorite
C#CON=N
ethynoxydiazene
CCC(F)NC
1-fluoro-N-methylpropan-1-amine
FCC(F)COI
(2,3-difluoropropyl)hypoiodite
COc1ccc(C)cc1C#CCCl
2-(3-chloroprop-1-ynyl)-1-methoxy-4-methylbenzene
OC=NCF
fluoromethyliminomethanol
FCC=CS
3-fluoroprop-1-ene-1-thiol
FCOI
fluoromethylhypoiodite
C=C(O)OCC(=O)F
2-(1-hydroxyethenyloxy)acetylfluoride
C#CNCF
N-ethynyl-1-fluoromethanamine
COCCN(I)CCI
N,2-diiodo-N-(2-methoxyethyl)ethanamine
COCC(N)F
1-fluoro-2-methoxyethanamine
SSc1cccc(Br)c1
1-bromo-3-(disulfanyl)benzene
N#CC(Cl)I
2-chloro-2-iodoacetonitrile
CC1(CO)CCCC(N)C1
(3-amino-1-methylcyclohexyl)methanol
OCC1CCCC1
cyclopentylmethanol
S=CNI
N-iodomethanethioamide
NC=CCS
3-aminoprop-2-ene-1-thiol
CC(N)O
1-aminoethanol
CNC(F)F
1,1-difluoro-N-methylmethanamine
CC1(C(O)N=O)CCCC1Br
(2-bromo-1-methylcyclopentyl)-nitrosomethanol
CC(CO)SI
1-hydroxypropan-2-ylthiohypoiodite
CNCC=NCl
N-chloro-2-(methylamino)ethanimine
C=C(F)OCl
1-fluoroethenylhypochlorite
N=CC1CCC(=N)C1
3-methanimidoylcyclopentan-1-imine
CC=CCCCC=O
hept-5-enal
OCOc1ccnc2c(Br)cccc12
(8-bromoquinolin-4-yl)oxymethanol
NCOc1ccc(CNC2CCCCCCC2)cc1Cl
N-[[4-(aminomethoxy)-3-chlorophenyl]methyl]cyclooctanamine
C=CSF
ethenylthiohypofluorite
CNN=O
N-methylnitrousamide
CNC(C)O
1-(methylamino)ethanol
CSN(N)SS
1-(disulfanyl)-1-methylsulfanylhydrazine
SC#CNS
2-(sulfanylamino)ethynethiol
S=CBr
bromomethanethioaldehyde
C=CSC=C
1-ethenylsulfanylethene
COc1cc(C=O)ccc1C
3-methoxy-4-methylbenzaldehyde
OC(F)(S)Br
bromo-fluoro-sulfanylmethanol
C#CCOC#C
1-prop-2-ynoxyethyne
CCC(C)N(C)CCS
2-[butan-2-yl(methyl)amino]ethanethiol
O=NCO
nitrosomethanol
C#CCCC
pent-1-yne
CCNC(Br)OC
N-[bromo(methoxy)methyl]ethanamine
CCN(C)C(=O)CCC(C)C
N-ethyl-N,4-dimethylpentanamide
CCN(CCNCCCO)c1ccc(F)cc1
3-[2-(N-ethyl-4-fluoroanilino)ethylamino]propan-1-ol
C[C@H](N)O
(1R)-1-aminoethanol
C=CCC(=O)NCC
N-ethylbut-3-enamide
C=CCNN
prop-2-enylhydrazine
CN(N)SN
S-[amino(methyl)amino]thiohydroxylamine
CC1CCC(Cl)CC1
1-chloro-4-methylcyclohexane
C=CCSI
prop-2-enylthiohypoiodite
C=CNC(=O)C(=O)NO
N'-ethenyl-N-hydroxyoxamide
CNCC1CCN(F)C1
1-(1-fluoropyrrolidin-3-yl)-N-methylmethanamine
CCCOCCO
2-propoxyethanol
NN(I)C1CNC1
1-(azetidin-3-yl)-1-iodohydrazine
FCC=S
2-fluoroethanethioaldehyde
OCCSS
2-(disulfanyl)ethanol
COCCn1c(CCl)nc2c(F)cccc21
2-(chloromethyl)-4-fluoro-1-(2-methoxyethyl)benzimidazole
NNC#CF
2-fluoroethynylhydrazine
NN(N)CF
1-amino-1-(fluoromethyl)hydrazine
C=CON=O
1-nitrosooxyethene
O=C(CO)SCl
(2-hydroxyacetyl)thiohypochlorite
N#CSI
cyanothiohypoiodite
COCC(C)=O
1-methoxypropan-2-one
CCCNCN=O
N-(nitrosomethyl)propan-1-amine
CN=CCF
2-fluoro-N-methylethanimine
N=C1CCC(NN)C1
(3-iminocyclopentyl)hydrazine
Cc1ccccc1C=NCc1ccccc1
N-benzyl-1-(2-methylphenyl)methanimine
N=NSCI
iodomethylsulfanyldiazene
SCC1CCOCC1
oxan-4-ylmethanethiol
CSCC(C)(C)OC(=O)NF
(2-methyl-1-methylsulfanylpropan-2-yl)N-fluorocarbamate
N=Cc1ccccc1
phenylmethanimine
C=CNC
N-methylethenamine
C#CN=C=O
1-isocyanatoethyne
CCOCCO
2-ethoxyethanol
N=CC(=CS)N=O
3-imino-2-nitrosoprop-1-ene-1-thiol
CCNCO
ethylaminomethanol
NC(=O)c1c(F)cccc1OI
(2-carbamoyl-3-fluorophenyl)hypoiodite
OC(Cl)Br
bromo(chloro)methanol
CC(Cl)C=S
2-chloropropanethioaldehyde
OSc1ccccc1
hydroxysulfanylbenzene
SNCBr
N-(bromomethyl)thiohydroxylamine
CCSCCO
2-ethylsulfanylethanol
C=C(O)OCF
1-(fluoromethoxy)ethenol
NNC(O)SCF
hydrazinyl(fluoromethylsulfanyl)methanol
CC(=N)OF
ethanimidoylhypofluorite
CON(F)C#N
fluoro-methoxycyanamide
CCN(C=CCSCC#N)CO
2-[3-[ethyl(hydroxymethyl)amino]prop-2-enylsulfanyl]acetonitrile
N=C1CCC1F
2-fluorocyclobutan-1-imine
OCN(CS)CCl
[chloromethyl(sulfanylmethyl)amino]methanol