3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)-N-(3-phenylsulfanylpropyl)propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)NCCCSC2=CC=CC=C2)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)NCCCSC2=CC=CC=C2)C)C#N

InChI

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