(2R)-2-(4-chlorophenyl)-3-methyl-1-[4-(phenylsulfonyl)piperazin-1-yl]butan-1-one

Systemtic Name: (2R)-2-(4-chlorophenyl)-3-methyl-1-[4-(phenylsulfonyl)piperazin-1-yl]butan-1-one Openeye Name: (2R)-1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(4-chlorophenyl)-3-methyl-butan-1-one CAS Name: (2R)-1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(4-chlorophenyl)-3-methyl-1-butanone IUPAC Name: (2R)-1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(4-chlorophenyl)-3-methylbutan-1-one Traditional Name: (2R)-1-(4-besylpiperazino)-2-(4-chlorophenyl)-3-methyl-butan-1-one Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@H](C1=CC=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25ClN2O3S/c1-16(2)20(17-8-10-18(22)11-9-17)21(25)23-12-14-24(15-13-23)28(26,27)19-6-4-3-5-7-19/h3-11,16,20H,12-15H2,1-2H3/t20-/m1/s1