ethyl 3-methyl-6-(3-methylphenyl)-4-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-methyl-6-(3-methylphenyl)-4-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-methyl-6-(m-tolyl)-4-[[4-(o-tolyl)piperazin-1-yl]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-methyl-6-(3-methylphenyl)-4-[[4-(2-methylphenyl)-1-piperazinyl]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-6-(3-methylphenyl)-4-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3-methyl-6-(m-tolyl)-4-[[4-(o-tolyl)piperazino]methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)C)C)CN3CCN(CC3)C4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)C)C)CN3CCN(CC3)C4=CC=CC=C4C

InChI

InChI=1S/C27H34N4O3/c1-5-34-26(32)24-23(29(4)27(33)28-25(24)21-11-8-9-19(2)17-21)18-30-13-15-31(16-14-30)22-12-7-6-10-20(22)3/h6-12,17,25H,5,13-16,18H2,1-4H3,(H,28,33)