S-(3-azanyl-3-oxidanylidene-prop-1-en-2-yl) 2-methyl-4-nitro-benzenecarbothioate

Systemtic Name: S-(3-azanyl-3-oxidanylidene-prop-1-en-2-yl) 2-methyl-4-nitro-benzenecarbothioate Openeye Name: S-(1-carbamoylvinyl) 2-methyl-4-nitro-benzenecarbothioate CAS Name: 2-methyl-4-nitrobenzenecarbothioic acid S-(3-amino-3-oxoprop-1-en-2-yl) ester IUPAC Name: S-(3-amino-3-oxoprop-1-en-2-yl) 2-methyl-4-nitrobenzenecarbothioate Traditional Name: 2-methyl-4-nitro-thiobenzoic acid S-(1-carbamoylvinyl) ester Formula: C11H10N2O4S MolecularWeight: 266.2731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)SC(=C)C(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)SC(=C)C(=O)N

InChI

InChI=1S/C11H10N2O4S/c1-6-5-8(13(16)17)3-4-9(6)11(15)18-7(2)10(12)14/h3-5H,2H2,1H3,(H2,12,14)