3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[2-(phenylmethylsulfanyl)ethyl]propanamide

Systemtic Name: 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-[2-(phenylmethylsulfanyl)ethyl]propanamide Openeye Name: N-(2-benzylsulfanylethyl)-3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanamide CAS Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-[2-(phenylmethylthio)ethyl]propanamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanamide Traditional Name: N-[2-(benzylthio)ethyl]-3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)propionamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)NCCSCC2=CC=CC=C2)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)NCCSCC2=CC=CC=C2)C)C#N

InChI

InChI=1S/C20H23N3O2S/c1-14-17(15(2)23-20(25)18(14)12-21)8-9-19(24)22-10-11-26-13-16-6-4-3-5-7-16/h3-7H,8-11,13H2,1-2H3,(H,22,24)(H,23,25)