2-(4-bromophenyl)sulfanyl-1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromophenyl)sulfanyl-1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-bromophenyl)sulfanyl-1-[4-(4-ethylbenzoyl)piperazin-1-yl]ethanone CAS Name: 2-[(4-bromophenyl)thio]-1-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromophenyl)sulfanyl-1-[4-(4-ethylbenzoyl)piperazin-1-yl]ethanone Traditional Name: 2-[(4-bromophenyl)thio]-1-[4-(4-ethylbenzoyl)piperazino]ethanone Formula: C21H23BrN2O2S MolecularWeight: 447.38852

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CSC3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H23BrN2O2S/c1-2-16-3-5-17(6-4-16)21(26)24-13-11-23(12-14-24)20(25)15-27-19-9-7-18(22)8-10-19/h3-10H,2,11-15H2,1H3