1-(4-bromanyl-2-tert-butyl-5-methyl-phenyl)sulfonyl-4-(2-methylphenyl)piperazine

Systemtic Name: 1-(4-bromanyl-2-tert-butyl-5-methyl-phenyl)sulfonyl-4-(2-methylphenyl)piperazine Openeye Name: 1-(4-bromo-2-tert-butyl-5-methyl-phenyl)sulfonyl-4-(o-tolyl)piperazine CAS Name: 1-(4-bromo-2-tert-butyl-5-methylphenyl)sulfonyl-4-(2-methylphenyl)piperazine IUPAC Name: 1-(4-bromo-2-tert-butyl-5-methylphenyl)sulfonyl-4-(2-methylphenyl)piperazine Traditional Name: 1-(4-bromo-2-tert-butyl-5-methyl-phenyl)sulfonyl-4-(o-tolyl)piperazine Formula: C22H29BrN2O2S MolecularWeight: 465.44686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)C)Br)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=C(C(=C3)C)Br)C(C)(C)C

InChI

InChI=1S/C22H29BrN2O2S/c1-16-8-6-7-9-20(16)24-10-12-25(13-11-24)28(26,27)21-14-17(2)19(23)15-18(21)22(3,4)5/h6-9,14-15H,10-13H2,1-5H3