4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidine

Systemtic Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidine Openeye Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2,6-dimethyl-5-(m-tolylmethyl)pyrimidine CAS Name: 4-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidine IUPAC Name: 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidine Traditional Name: 4-(4-brosylpiperazino)-2,6-dimethyl-5-(3-methylbenzyl)pyrimidine Formula: C24H27BrN4O2S MolecularWeight: 515.46578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C(N=C(N=C2N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C(N=C(N=C2N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br)C)C

InChI

InChI=1S/C24H27BrN4O2S/c1-17-5-4-6-20(15-17)16-23-18(2)26-19(3)27-24(23)28-11-13-29(14-12-28)32(30,31)22-9-7-21(25)8-10-22/h4-10,15H,11-14,16H2,1-3H3