(phenylmethyl) 2,4-dimethyl-6-[3-methyl-4-(4-methylphenyl)carbonyl-piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 2,4-dimethyl-6-[3-methyl-4-(4-methylphenyl)carbonyl-piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate Openeye Name: benzyl 2,4-dimethyl-6-[3-methyl-4-(4-methylbenzoyl)piperazine-1-carbonyl]pyrimidine-5-carboxylate CAS Name: 2,4-dimethyl-6-[[3-methyl-4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-5-pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2,4-dimethyl-6-[3-methyl-4-(4-methylbenzoyl)piperazine-1-carbonyl]pyrimidine-5-carboxylate Traditional Name: 2,4-dimethyl-6-(3-methyl-4-p-toluoyl-piperazine-1-carbonyl)pyrimidine-5-carboxylic acid benzyl ester Formula: C28H30N4O4 MolecularWeight: 486.5622

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC=C(C=C2)C)C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC=C(C=C2)C)C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H30N4O4/c1-18-10-12-23(13-11-18)26(33)32-15-14-31(16-19(32)2)27(34)25-24(20(3)29-21(4)30-25)28(35)36-17-22-8-6-5-7-9-22/h5-13,19H,14-17H2,1-4H3