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

Systemtic Name: N-(4-bromophenyl)-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-(4-bromophenyl)propanamide CAS Name: N-(4-bromophenyl)-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-(4-bromophenyl)propanamide Traditional Name: 2-(benzylthio)-N-(4-bromophenyl)propionamide Formula: C16H16BrNOS MolecularWeight: 350.27334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrNOS/c1-12(20-11-13-5-3-2-4-6-13)16(19)18-15-9-7-14(17)8-10-15/h2-10,12H,11H2,1H3,(H,18,19)