1-[(4-bromophenyl)methyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(4-bromophenyl)methyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine Openeye Name: 1-[(4-bromophenyl)methyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine CAS Name: 1-[(4-bromophenyl)methyl]-4-(2,4,6-trimethylphenyl)sulfonylpiperazine IUPAC Name: 1-[(4-bromophenyl)methyl]-4-(2,4,6-trimethylphenyl)sulfonylpiperazine Traditional Name: 1-(4-bromobenzyl)-4-mesitylsulfonyl-piperazine Formula: C20H25BrN2O2S MolecularWeight: 437.3937

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrN2O2S/c1-15-12-16(2)20(17(3)13-15)26(24,25)23-10-8-22(9-11-23)14-18-4-6-19(21)7-5-18/h4-7,12-13H,8-11,14H2,1-3H3