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

Systemtic Name: (3-bromophenyl)-[4-[6-methyl-2-(4-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-[5-isopropyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-[6-methyl-2-(4-methylphenyl)-5-propan-2-yl-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-[6-methyl-2-(4-methylphenyl)-5-propan-2-ylpyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-[5-isopropyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazino]methanone Formula: C26H29BrN4O MolecularWeight: 493.43866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br)C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br)C(C)C)C

InChI

InChI=1S/C26H29BrN4O/c1-17(2)23-19(4)28-24(20-10-8-18(3)9-11-20)29-25(23)30-12-14-31(15-13-30)26(32)21-6-5-7-22(27)16-21/h5-11,16-17H,12-15H2,1-4H3