N-(4-methylphenyl)-2-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-(4-methylphenyl)-2-(phenylmethylsulfanyl)butanamide Openeye Name: 2-benzylsulfanyl-N-(p-tolyl)butanamide CAS Name: N-(4-methylphenyl)-2-(phenylmethylthio)butanamide IUPAC Name: 2-benzylsulfanyl-N-(4-methylphenyl)butanamide Traditional Name: 2-(benzylthio)-N-(p-tolyl)butyramide Formula: C18H21NOS MolecularWeight: 299.43044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C)SCC2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C)SCC2=CC=CC=C2

InChI

InChI=1S/C18H21NOS/c1-3-17(21-13-15-7-5-4-6-8-15)18(20)19-16-11-9-14(2)10-12-16/h4-12,17H,3,13H2,1-2H3,(H,19,20)