4-(4-methylphenyl)-4-oxidanylidene-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]butanamide

Systemtic Name: 4-(4-methylphenyl)-4-oxidanylidene-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]butanamide Openeye Name: 4-oxo-4-(p-tolyl)-N-[4-(3-pyridylmethylsulfanyl)phenyl]butanamide CAS Name: 4-(4-methylphenyl)-4-oxo-N-[4-(3-pyridinylmethylthio)phenyl]butanamide IUPAC Name: 4-(4-methylphenyl)-4-oxo-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]butanamide Traditional Name: 4-keto-4-(p-tolyl)-N-[4-(3-pyridylmethylthio)phenyl]butyramide Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

InChI

InChI=1S/C23H22N2O2S/c1-17-4-6-19(7-5-17)22(26)12-13-23(27)25-20-8-10-21(11-9-20)28-16-18-3-2-14-24-15-18/h2-11,14-15H,12-13,16H2,1H3,(H,25,27)