2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)-N-(2-phenylsulfanylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)-N-(2-phenylsulfanylphenyl)ethanamide Openeye Name: 2-(3-cyano-5-nitro-2-oxo-1-pyridyl)-N-(2-phenylsulfanylphenyl)acetamide CAS Name: 2-(3-cyano-5-nitro-2-oxo-1-pyridinyl)-N-[2-(phenylthio)phenyl]acetamide IUPAC Name: 2-(3-cyano-5-nitro-2-oxopyridin-1-yl)-N-(2-phenylsulfanylphenyl)acetamide Traditional Name: 2-(3-cyano-2-keto-5-nitro-1-pyridyl)-N-[2-(phenylthio)phenyl]acetamide Formula: C20H14N4O4S MolecularWeight: 406.41456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O4S/c21-11-14-10-15(24(27)28)12-23(20(14)26)13-19(25)22-17-8-4-5-9-18(17)29-16-6-2-1-3-7-16/h1-10,12H,13H2,(H,22,25)