5-cyano-6-methylsulfanyl-2-oxidanylidene-N-phenethyl-N-(phenylmethyl)-1H-pyridine-3-carboxamide

Systemtic Name: 5-cyano-6-methylsulfanyl-2-oxidanylidene-N-phenethyl-N-(phenylmethyl)-1H-pyridine-3-carboxamide Openeye Name: N-benzyl-5-cyano-6-methylsulfanyl-2-oxo-N-phenethyl-1H-pyridine-3-carboxamide CAS Name: 5-cyano-6-(methylthio)-2-oxo-N-phenethyl-N-(phenylmethyl)-1H-pyridine-3-carboxamide IUPAC Name: N-benzyl-5-cyano-6-methylsulfanyl-2-oxo-N-phenethyl-1H-pyridine-3-carboxamide Traditional Name: N-benzyl-5-cyano-2-keto-6-(methylthio)-N-phenethyl-1H-pyridine-3-carboxamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C(=O)N1)C(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C#N

Isomeric SMILES

CSC1=C(C=C(C(=O)N1)C(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C#N

InChI

InChI=1S/C23H21N3O2S/c1-29-22-19(15-24)14-20(21(27)25-22)23(28)26(16-18-10-6-3-7-11-18)13-12-17-8-4-2-5-9-17/h2-11,14H,12-13,16H2,1H3,(H,25,27)