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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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