N-(3-cyanophenyl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(3-cyanophenyl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: 3-benzylsulfanyl-N-(3-cyanophenyl)propanamide CAS Name: N-(3-cyanophenyl)-3-(phenylmethylthio)propanamide IUPAC Name: 3-benzylsulfanyl-N-(3-cyanophenyl)propanamide Traditional Name: 3-(benzylthio)-N-(3-cyanophenyl)propionamide Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSCCC(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H16N2OS/c18-12-15-7-4-8-16(11-15)19-17(20)9-10-21-13-14-5-2-1-3-6-14/h1-8,11H,9-10,13H2,(H,19,20)