1-(3-bromophenyl)sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine

Systemtic Name: 1-(3-bromophenyl)sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine Openeye Name: 1-(3-bromophenyl)sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine CAS Name: 1-(3-bromophenyl)sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine IUPAC Name: 1-(3-bromophenyl)sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine Traditional Name: 1-(3-bromophenyl)sulfonyl-4-(4-tert-butylbenzyl)piperazine Formula: C21H27BrN2O2S MolecularWeight: 451.42028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

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