1-[(4-bromophenyl)methyl]-4-(4-tert-butylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4-bromophenyl)methyl]-4-(4-tert-butylphenyl)sulfonyl-piperazine Openeye Name: 1-[(4-bromophenyl)methyl]-4-(4-tert-butylphenyl)sulfonyl-piperazine CAS Name: 1-[(4-bromophenyl)methyl]-4-(4-tert-butylphenyl)sulfonylpiperazine IUPAC Name: 1-[(4-bromophenyl)methyl]-4-(4-tert-butylphenyl)sulfonylpiperazine Traditional Name: 1-(4-bromobenzyl)-4-(4-tert-butylphenyl)sulfonyl-piperazine Formula: C21H27BrN2O2S MolecularWeight: 451.42028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27BrN2O2S/c1-21(2,3)18-6-10-20(11-7-18)27(25,26)24-14-12-23(13-15-24)16-17-4-8-19(22)9-5-17/h4-11H,12-16H2,1-3H3