N-(3-chloranyl-4-methoxy-phenyl)-2-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-(phenylmethylsulfanyl)butanamide Openeye Name: 2-benzylsulfanyl-N-(3-chloro-4-methoxy-phenyl)butanamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-(phenylmethylthio)butanamide IUPAC Name: 2-benzylsulfanyl-N-(3-chloro-4-methoxyphenyl)butanamide Traditional Name: 2-(benzylthio)-N-(3-chloro-4-methoxy-phenyl)butyramide Formula: C18H20ClNO2S MolecularWeight: 349.8749

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClNO2S/c1-3-17(23-12-13-7-5-4-6-8-13)18(21)20-14-9-10-16(22-2)15(19)11-14/h4-11,17H,3,12H2,1-2H3,(H,20,21)