N-[4-[4-(2-bromophenyl)carbonylpiperazin-1-yl]phenyl]-2-(4-chlorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[4-[4-(2-bromophenyl)carbonylpiperazin-1-yl]phenyl]-2-(4-chlorophenyl)sulfanyl-ethanamide Openeye Name: N-[4-[4-(2-bromobenzoyl)piperazin-1-yl]phenyl]-2-(4-chlorophenyl)sulfanyl-acetamide CAS Name: N-[4-[4-[(2-bromophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-[(4-chlorophenyl)thio]acetamide IUPAC Name: N-[4-[4-(2-bromobenzoyl)piperazin-1-yl]phenyl]-2-(4-chlorophenyl)sulfanylacetamide Traditional Name: N-[4-[4-(2-bromobenzoyl)piperazino]phenyl]-2-[(4-chlorophenyl)thio]acetamide Formula: C25H23BrClN3O2S MolecularWeight: 544.89102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Cl)C(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Cl)C(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C25H23BrClN3O2S/c26-23-4-2-1-3-22(23)25(32)30-15-13-29(14-16-30)20-9-7-19(8-10-20)28-24(31)17-33-21-11-5-18(27)6-12-21/h1-12H,13-17H2,(H,28,31)