methyl 4-[(2-azanyl-2-oxidanylidene-ethanethioyl)amino]benzoate

Systemtic Name: methyl 4-[(2-azanyl-2-oxidanylidene-ethanethioyl)amino]benzoate Openeye Name: methyl 4-[(2-amino-2-oxo-ethanethioyl)amino]benzoate CAS Name: 4-[(2-amino-2-oxo-1-sulfanylideneethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-amino-2-oxoethanethioyl)amino]benzoate Traditional Name: 4-[(2-amino-2-keto-thioacetyl)amino]benzoic acid methyl ester Formula: C10H10N2O3S MolecularWeight: 238.263

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)C(=O)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)C(=O)N

InChI

InChI=1S/C10H10N2O3S/c1-15-10(14)6-2-4-7(5-3-6)12-9(16)8(11)13/h2-5H,1H3,(H2,11,13)(H,12,16)