2-(4-bromophenyl)sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromophenyl)sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(4-bromophenyl)sulfanyl-ethanone CAS Name: 2-[(4-bromophenyl)thio]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(4-bromophenyl)sulfanylethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[(4-bromophenyl)thio]ethanone Formula: C19H21BrN2O3S2 MolecularWeight: 469.41564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=CC=C(C=C2)Br)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=CC=C(C=C2)Br)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H21BrN2O3S2/c20-17-6-8-18(9-7-17)26-14-19(23)21-10-12-22(13-11-21)27(24,25)15-16-4-2-1-3-5-16/h1-9H,10-15H2