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

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-(4-methylphenyl)sulfonyl-piperazine Openeye Name: 1-[(3-bromophenyl)methyl]-4-(p-tolylsulfonyl)piperazine CAS Name: 1-[(3-bromophenyl)methyl]-4-(4-methylphenyl)sulfonylpiperazine IUPAC Name: 1-[(3-bromophenyl)methyl]-4-(4-methylphenyl)sulfonylpiperazine Traditional Name: 1-(3-bromobenzyl)-4-tosyl-piperazine Formula: C18H21BrN2O2S MolecularWeight: 409.34054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrN2O2S/c1-15-5-7-18(8-6-15)24(22,23)21-11-9-20(10-12-21)14-16-3-2-4-17(19)13-16/h2-8,13H,9-12,14H2,1H3