1-[4-(2-methylpropyl)phenyl]sulfonyl-4-(phenylmethyl)sulfonyl-piperazine

Systemtic Name: 1-[4-(2-methylpropyl)phenyl]sulfonyl-4-(phenylmethyl)sulfonyl-piperazine Openeye Name: 1-benzylsulfonyl-4-(4-isobutylphenyl)sulfonyl-piperazine CAS Name: 1-[4-(2-methylpropyl)phenyl]sulfonyl-4-(phenylmethyl)sulfonylpiperazine IUPAC Name: 1-benzylsulfonyl-4-[4-(2-methylpropyl)phenyl]sulfonylpiperazine Traditional Name: 1-benzylsulfonyl-4-(4-isobutylphenyl)sulfonyl-piperazine Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O4S2/c1-18(2)16-19-8-10-21(11-9-19)29(26,27)23-14-12-22(13-15-23)28(24,25)17-20-6-4-3-5-7-20/h3-11,18H,12-17H2,1-2H3