2-(2-bromophenyl)sulfanyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(2-bromophenyl)sulfanyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(2-bromophenyl)sulfanyl-acetamide CAS Name: 2-[(2-bromophenyl)thio]-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(2-bromophenyl)sulfanylacetamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-[(2-bromophenyl)thio]acetamide Formula: C25H26BrN3OS MolecularWeight: 496.46244

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CSC4=CC=CC=C4Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CSC4=CC=CC=C4Br

InChI

InChI=1S/C25H26BrN3OS/c26-23-8-4-5-9-24(23)31-19-25(30)27-21-10-12-22(13-11-21)29-16-14-28(15-17-29)18-20-6-2-1-3-7-20/h1-13H,14-19H2,(H,27,30)