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

Systemtic Name: 2-(3-cyano-5-ethanoyl-6-methyl-pyridin-2-yl)sulfanyl-N-(4-methoxy-2-nitro-phenyl)ethanamide Openeye Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-(4-methoxy-2-nitro-phenyl)acetamide CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridinyl)thio]-N-(4-methoxy-2-nitrophenyl)acetamide IUPAC Name: 2-(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl-N-(4-methoxy-2-nitrophenyl)acetamide Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-2-pyridyl)thio]-N-(4-methoxy-2-nitro-phenyl)acetamide Formula: C18H16N4O5S MolecularWeight: 400.40844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N4O5S/c1-10-14(11(2)23)6-12(8-19)18(20-10)28-9-17(24)21-15-5-4-13(27-3)7-16(15)22(25)26/h4-7H,9H2,1-3H3,(H,21,24)