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

Systemtic Name: cyclopentyl-[4-[6-methyl-2-(3-methylphenyl)-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: [4-[5-benzyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]-cyclopentyl-methanone CAS Name: cyclopentyl-[4-[6-methyl-2-(3-methylphenyl)-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: [4-[5-benzyl-6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-cyclopentylmethanone Traditional Name: [4-[5-benzyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]-cyclopentyl-methanone Formula: C29H34N4O MolecularWeight: 454.60646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C4CCCC4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C4CCCC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C29H34N4O/c1-21-9-8-14-25(19-21)27-30-22(2)26(20-23-10-4-3-5-11-23)28(31-27)32-15-17-33(18-16-32)29(34)24-12-6-7-13-24/h3-5,8-11,14,19,24H,6-7,12-13,15-18,20H2,1-2H3