(3-bromophenyl)-[4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-[2,6-dimethyl-5-(p-tolylmethyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-[2,6-dimethyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-[2,6-dimethyl-5-(4-methylbenzyl)pyrimidin-4-yl]piperazino]methanone Formula: C25H27BrN4O MolecularWeight: 479.41208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27BrN4O/c1-17-7-9-20(10-8-17)15-23-18(2)27-19(3)28-24(23)29-11-13-30(14-12-29)25(31)21-5-4-6-22(26)16-21/h4-10,16H,11-15H2,1-3H3