1-[4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]-3-cyclopentyl-propan-1-one

Systemtic Name: 1-[4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazin-1-yl]-3-cyclopentyl-propan-1-one Openeye Name: 1-[4-[5-benzyl-2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]-3-cyclopentyl-propan-1-one CAS Name: 1-[4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinyl]-3-cyclopentyl-1-propanone IUPAC Name: 1-[4-[5-benzyl-2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]-3-cyclopentylpropan-1-one Traditional Name: 1-[4-[5-benzyl-2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]-3-cyclopentyl-propan-1-one Formula: C30H35ClN4O MolecularWeight: 503.0781

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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)CCC4CCCC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)N3CCN(CC3)C(=O)CCC4CCCC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H35ClN4O/c1-22-27(21-24-9-3-2-4-10-24)30(33-29(32-22)25-12-14-26(31)15-13-25)35-19-17-34(18-20-35)28(36)16-11-23-7-5-6-8-23/h2-4,9-10,12-15,23H,5-8,11,16-21H2,1H3