1-[(3-chlorophenyl)methyl]-4-[4-(2-methylpropyl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-[(3-chlorophenyl)methyl]-4-[4-(2-methylpropyl)phenyl]sulfonyl-piperazine Openeye Name: 1-[(3-chlorophenyl)methyl]-4-(4-isobutylphenyl)sulfonyl-piperazine CAS Name: 1-[(3-chlorophenyl)methyl]-4-[4-(2-methylpropyl)phenyl]sulfonylpiperazine IUPAC Name: 1-[(3-chlorophenyl)methyl]-4-[4-(2-methylpropyl)phenyl]sulfonylpiperazine Traditional Name: 1-(3-chlorobenzyl)-4-(4-isobutylphenyl)sulfonyl-piperazine Formula: C21H27ClN2O2S MolecularWeight: 406.96928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H27ClN2O2S/c1-17(2)14-18-6-8-21(9-7-18)27(25,26)24-12-10-23(11-13-24)16-19-4-3-5-20(22)15-19/h3-9,15,17H,10-14,16H2,1-2H3