S-(3-azanyl-3-oxidanylidene-prop-1-en-2-yl) 2,4-dimethylbenzenecarbothioate

Systemtic Name: S-(3-azanyl-3-oxidanylidene-prop-1-en-2-yl) 2,4-dimethylbenzenecarbothioate Openeye Name: S-(1-carbamoylvinyl) 2,4-dimethylbenzenecarbothioate CAS Name: 2,4-dimethylbenzenecarbothioic acid S-(3-amino-3-oxoprop-1-en-2-yl) ester IUPAC Name: S-(3-amino-3-oxoprop-1-en-2-yl) 2,4-dimethylbenzenecarbothioate Traditional Name: 2,4-dimethylthiobenzoic acid S-(1-carbamoylvinyl) ester Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)SC(=C)C(=O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)SC(=C)C(=O)N)C

InChI

InChI=1S/C12H13NO2S/c1-7-4-5-10(8(2)6-7)12(15)16-9(3)11(13)14/h4-6H,3H2,1-2H3,(H2,13,14)