Search MNXref
 Feedback

S-Methyl benzenecarbothioate

PropertiesImage
MNX_IDMNXM114703 Image of MNXM114703
referencechebi:169501
formulaC8H8OS
global charge0
mol weight152.218
InChIKeyRQVWTMCUTHKGCM-UHFFFAOYSA-N
InChIInChI=1S/C8H8OS/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3
SMILESCSC(=O)C1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C8H8OS/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3 Image of MNXM114703
SMILES (mnx)[CH3:1][S:10][C:8]([C:7]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1)=[O:9]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:169501
chebi:169501
RQVWTMCUTHKGCM-UHFFFAOYSA-N
S-Methyl benzenecarbothioate
S-methyl benzenecarbothioate

metacyc.compound:CPD-14756
metacycM:CPD-14756
seed.compound:cpd35487
seedM:cpd35487
RQVWTMCUTHKGCM-UHFFFAOYSA-N
(S)-methyl thiobenzoate
S-ethyl benzothioate
S-methyl benzenecarbothioate
methylthiobenzoate
methylthiobenzoic acid
thiobenzoic acid methyl ester
thiobenzoic acid methylthioester
hmdb:HMDB0029694
RQVWTMCUTHKGCM-UHFFFAOYSA-N
S-Methyl benzenecarbothioate
(Methylsulphanyl)(phenyl)methanone
(S)-Methyl thiobenzoate
(methylsulfanyl)(phenyl)methanone
Benzenecarbothioic acid, S-methyl ester
Benzoic acid, thio-, S-methyl ester
Methyl thiobenzoate
S-Ethyl benzothioate
S-Methyl benzenecarbothioic acid
S-Methyl benzothioate
S-Methyl thiobenzoate
Thiobenzoic acid S-methyl ester

hmdb:HMDB29694
seedM:M_cpd35487
secondary/obsolete/fantasy identifier