2-[(4-bromophenyl)methylsulfanyl]-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-bromophenyl)methylthio]-1-[4-(3-chlorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-bromobenzyl)thio]-1-[4-(3-chlorophenyl)piperazino]ethanone Formula: C19H20BrClN2OS MolecularWeight: 439.7969

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSCC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSCC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H20BrClN2OS/c20-16-6-4-15(5-7-16)13-25-14-19(24)23-10-8-22(9-11-23)18-3-1-2-17(21)12-18/h1-7,12H,8-11,13-14H2