1-[4-[6-ethyl-5-[(4-methylphenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[6-ethyl-5-[(4-methylphenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[6-ethyl-2-phenyl-5-(p-tolylmethyl)pyrimidin-4-yl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[6-ethyl-5-[(4-methylphenyl)methyl]-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[6-ethyl-5-[(4-methylphenyl)methyl]-2-phenylpyrimidin-4-yl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[6-ethyl-5-(4-methylbenzyl)-2-phenyl-pyrimidin-4-yl]piperazino]-2-methyl-propan-1-one Formula: C28H34N4O MolecularWeight: 442.59576

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C(C)C)CC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C(C)C)CC4=CC=C(C=C4)C

InChI

InChI=1S/C28H34N4O/c1-5-25-24(19-22-13-11-21(4)12-14-22)27(30-26(29-25)23-9-7-6-8-10-23)31-15-17-32(18-16-31)28(33)20(2)3/h6-14,20H,5,15-19H2,1-4H3