N-(4-cyanophenyl)-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(4-cyanophenyl)-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-(4-cyanophenyl)propanamide CAS Name: N-(4-cyanophenyl)-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-(4-cyanophenyl)propanamide Traditional Name: 2-(benzylthio)-N-(4-cyanophenyl)propionamide Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)SCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C#N)SCC2=CC=CC=C2

InChI

InChI=1S/C17H16N2OS/c1-13(21-12-15-5-3-2-4-6-15)17(20)19-16-9-7-14(11-18)8-10-16/h2-10,13H,12H2,1H3,(H,19,20)