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

Systemtic Name: [4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]-cyclopentyl-methanone Openeye Name: [4-[5-benzyl-2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-cyclopentyl-methanone CAS Name: [4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinyl]-cyclopentylmethanone IUPAC Name: [4-[5-benzyl-2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]-cyclopentylmethanone Traditional Name: [4-[5-benzyl-2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]-cyclopentyl-methanone Formula: C28H31ClN4O MolecularWeight: 475.02494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)N3CCN(CC3)C(=O)C4CCCC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)N3CCN(CC3)C(=O)C4CCCC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H31ClN4O/c1-20-25(19-21-7-3-2-4-8-21)27(31-26(30-20)22-11-13-24(29)14-12-22)32-15-17-33(18-16-32)28(34)23-9-5-6-10-23/h2-4,7-8,11-14,23H,5-6,9-10,15-19H2,1H3