1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-4-(3-chlorophenyl)piperazine

Systemtic Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-4-(3-chlorophenyl)piperazine Openeye Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-4-(3-chlorophenyl)piperazine CAS Name: 1-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-4-(3-chlorophenyl)piperazine IUPAC Name: 1-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-4-(3-chlorophenyl)piperazine Traditional Name: 1-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonyl-4-(3-chlorophenyl)piperazine Formula: C22H29ClN2O2S MolecularWeight: 420.99586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C)C(C)(C)C

InChI

InChI=1S/C22H29ClN2O2S/c1-16-13-18(22(3,4)5)14-17(2)21(16)28(26,27)25-11-9-24(10-12-25)20-8-6-7-19(23)15-20/h6-8,13-15H,9-12H2,1-5H3