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

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[(3-bromophenyl)methylthio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(3-bromobenzyl)thio]-1-(4-phenylpiperazino)ethanone Formula: C19H21BrN2OS MolecularWeight: 405.35184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN2OS/c20-17-6-4-5-16(13-17)14-24-15-19(23)22-11-9-21(10-12-22)18-7-2-1-3-8-18/h1-8,13H,9-12,14-15H2