(1-ethanoyl-4-oxidanylidene-cinnolin-3-yl)sulfanylmethyl ethanoate

Systemtic Name: (1-ethanoyl-4-oxidanylidene-cinnolin-3-yl)sulfanylmethyl ethanoate Openeye Name: (1-acetyl-4-oxo-cinnolin-3-yl)sulfanylmethyl acetate CAS Name: acetic acid [(1-acetyl-4-oxo-3-cinnolinyl)thio]methyl ester IUPAC Name: (1-acetyl-4-oxocinnolin-3-yl)sulfanylmethyl acetate Traditional Name: acetic acid [(1-acetyl-4-keto-cinnolin-3-yl)thio]methyl ester Formula: C13H12N2O4S MolecularWeight: 292.31038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC=CC=C2C(=O)C(=N1)SCOC(=O)C

Isomeric SMILES

CC(=O)N1C2=CC=CC=C2C(=O)C(=N1)SCOC(=O)C

InChI

InChI=1S/C13H12N2O4S/c1-8(16)15-11-6-4-3-5-10(11)12(18)13(14-15)20-7-19-9(2)17/h3-6H,7H2,1-2H3