2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(4-nitrophenyl)acetamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-(4-nitrophenyl)acetamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-(4-nitrophenyl)acetamide Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C#N)C(=O)C

InChI

InChI=1S/C17H14N4O4S/c1-10-15(11(2)22)7-12(8-18)17(19-10)26-9-16(23)20-13-3-5-14(6-4-13)21(24)25/h3-7H,9H2,1-2H3,(H,20,23)