N-(3-bromophenyl)-4-[(phenylmethylsulfanyl)methyl]benzamide

Systemtic Name: N-(3-bromophenyl)-4-[(phenylmethylsulfanyl)methyl]benzamide Openeye Name: 4-(benzylsulfanylmethyl)-N-(3-bromophenyl)benzamide CAS Name: N-(3-bromophenyl)-4-[(phenylmethylthio)methyl]benzamide IUPAC Name: 4-(benzylsulfanylmethyl)-N-(3-bromophenyl)benzamide Traditional Name: 4-[(benzylthio)methyl]-N-(3-bromophenyl)benzamide Formula: C21H18BrNOS MolecularWeight: 412.34272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H18BrNOS/c22-19-7-4-8-20(13-19)23-21(24)18-11-9-17(10-12-18)15-25-14-16-5-2-1-3-6-16/h1-13H,14-15H2,(H,23,24)