SMILES
stringlengths
2
905
IUPAC
stringlengths
6
1.74k
FCN=CS
N-(fluoromethyl)methanimidothioicacid
CC(S)NCN
1-(aminomethylamino)ethanethiol
COC1CC=C(C)CC1
4-methoxy-1-methylcyclohexene
CSCCNCC1CC2CCC1C2
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-methylsulfanylethanamine
CBCl
chloro(methyl)borane
Oc1ccc(F)cc1O
4-fluorobenzene-1,2-diol
CNC(=O)C(S)CF
3-fluoro-N-methyl-2-sulfanylpropanamide
COC(C)SO
1-hydroxysulfanyl-1-methoxyethane
C=CSCI
1-(iodomethylsulfanyl)ethene
ClBBr
bromo(chloro)borane
CSSC
methyldisulfanylmethane
C#CBF
ethynyl(fluoro)borane
S=CCI
2-iodoethanethioaldehyde
COC1CC=C([C@@H](O)CCN(C)I)CC1
(1S)-3-[iodo(methyl)amino]-1-(4-methoxycyclohexen-1-yl)propan-1-ol
CCSC(S)Br
bromo(ethylsulfanyl)methanethiol
SNC=CCl
N-(2-chloroethenyl)thiohydroxylamine
C=C(Br)BO
1-bromoethenylborinicacid
CC(N)CNO
N-(2-aminopropyl)hydroxylamine
CC(I)BI
1-iodoethyl(iodo)borane
CC(C)(F)BO
2-fluoropropan-2-ylborinicacid
NCCCCF
4-fluorobutan-1-amine
OCSCCl
chloromethylsulfanylmethanol
CN(C)S
N,N-dimethylthiohydroxylamine
ON=CI
N-hydroxymethanimidoyliodide
CN=COC
methylN-methylmethanimidate
[2H]CI
deuterio(iodo)methane
N#CBBO
cyanoboranylborinicacid
NC(S)I
amino(iodo)methanethiol
CON1CCC2(CCOCC2)C1
2-methoxy-8-oxa-2-azaspiro[4.5]decane
CN(F)CI
N-fluoro-1-iodo-N-methylmethanamine
CNC(I)SC
1-iodo-N-methyl-1-methylsulfanylmethanamine
CCCC=NF
N-fluorobutan-1-imine
OC=NS
N-sulfanylmethanimidicacid
CN=CCBO
2-methyliminoethylborinicacid
O=BCl
chloro(oxo)borane
CCN(N)O
N-amino-N-ethylhydroxylamine
Cc1nnc2c(I)nccn12
8-iodo-3-methyl-[1,2,4]triazolo[4,3-a]pyrazine
N=CC1=CC=CCC1
cyclohexa-1,3-dien-1-ylmethanimine
C=CCC(C)(C)S
2-methylpent-4-ene-2-thiol
N#COO
hydroperoxyformonitrile
N=NBr
bromodiazene
CCSC1CCCCN1c1ccc(C(C)N)cc1Cl
1-[3-chloro-4-(2-ethylsulfanylpiperidin-1-yl)phenyl]ethanamine
CNC(S)OCI
iodomethoxy(methylamino)methanethiol
COCCNCCl
N-(chloromethyl)-2-methoxyethanamine
CCSOCC=O
2-ethylsulfanyloxyacetaldehyde
N#CCCI
3-iodopropanenitrile
FCCSI
2-fluoroethylthiohypoiodite
ONCCC=S
3-(hydroxyamino)propanethial
S=CSSS
trisulfanylmethanethioaldehyde
N=NC(F)Br
[bromo(fluoro)methyl]diazene
SCC=NCS
2-sulfanylethylideneaminomethanethiol
C=CNCF
N-ethenyl-1-fluoromethanamine
CCN=NCCI
ethyl(2-iodoethyl)diazene
N#CC=CCl
3-chloroprop-2-enenitrile
CONC(=O)c1ccc(Br)s1
5-bromo-N-methoxythiophene-2-carboxamide
N=COI
methanimidoylhypoiodite
C=NOCC#N
2-(methylideneamino)oxyacetonitrile
CON(C)C(=O)CNN
2-hydrazinyl-N-methoxy-N-methylacetamide
CCC1CN(BO)CCO1
(2-ethylmorpholin-4-yl)borinicacid
CC(F)CF
1,2-difluoropropane
ICC#CC1CCOCC1
4-(3-iodoprop-1-ynyl)oxane
CCB(O)O
ethylboronicacid
CC(O)SO
1-hydroxysulfanylethanol
N=NCCCl
2-chloroethyldiazene
CN=CNO
N-(methyliminomethyl)hydroxylamine
O=NBI
iodo(nitroso)borane
FN=NI
fluoro(iodo)diazene
FNCCBr
2-bromo-N-fluoroethanamine
N=CCC(N)I
1-iodo-3-iminopropan-1-amine
Clc1c[nH]c2cc(C(Cl)I)ccc12
3-chloro-6-[chloro(iodo)methyl]-1H-indole
SCC(S)SS
2-(disulfanyl)-2-sulfanylethanethiol
Cc1cccc(C#N)c1C#N
3-methylbenzene-1,2-dicarbonitrile
C=C(CC)NF
N-fluorobut-1-en-2-amine
COOB(Br)N=O
bromo(methylperoxy)-nitrosoborane
CCCCC(C)CBO
2-methylhexylborinicacid
ClC#CBr
1-bromo-2-chloroethyne
CCOCSS
ethoxy(disulfanyl)methane
CONC(c1ccncc1)c1ccc(OSC)cc1
N-methoxy-1-(4-methylsulfanyloxyphenyl)-1-pyridin-4-ylmethanamine
FCCBr
1-bromo-2-fluoroethane
NC(=O)c1ccc(N)cc1
4-aminobenzamide
CCCNC(=S)NCC
1-ethyl-3-propylthiourea
CC(C)C(C)C#N
2,3-dimethylbutanenitrile
C=CBO
ethenylborinicacid
COC=NOC
methylN-methoxymethanimidate
ClNC1CCCCC1
N-chlorocyclohexanamine
SN(Br)I
N-bromo-N-iodothiohydroxylamine
CC1CC1CI
1-(iodomethyl)-2-methylcyclopropane
NN(Cl)CF
1-chloro-1-(fluoromethyl)hydrazine
C=C(Br)NF
1-bromo-N-fluoroethenamine
N=COO
hydroperoxymethanimine
COCCCC=NI
N-iodo-4-methoxybutan-1-imine
CC(C)CI
1-iodo-2-methylpropane
CC=NC#CC1=C(C#CN=CCS)OCC1
2-[2-[4-[2-(ethylideneamino)ethynyl]-2,3-dihydrofuran-5-yl]ethynylimino]ethanethiol
CCCCC(C)(C)C
2,2-dimethylhexane
N=C1CC1CS
(2-iminocyclopropyl)methanethiol
CC#CCC
pent-2-yne
OC(I)NS
iodo(sulfanylamino)methanol
OC(Cl)SI
[chloro(hydroxy)methyl]thiohypoiodite
CCNCCS
2-(ethylamino)ethanethiol