4-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[(3-cyano-6-keto-4-methyl-1H-pyridin-2-yl)thio]methyl]-N-phenyl-benzamide Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC(=C1C#N)SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)NC(=C1C#N)SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H17N3O2S/c1-14-11-19(25)24-21(18(14)12-22)27-13-15-7-9-16(10-8-15)20(26)23-17-5-3-2-4-6-17/h2-11H,13H2,1H3,(H,23,26)(H,24,25)