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

Systemtic Name: ethyl 3-methyl-6-(2-methylphenyl)-4-[[4-(4-methylphenyl)carbonylpiperazin-1-yl]methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-methyl-4-[[4-(4-methylbenzoyl)piperazin-1-yl]methyl]-6-(o-tolyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-methyl-6-(2-methylphenyl)-4-[[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-[[4-(4-methylbenzoyl)piperazin-1-yl]methyl]-6-(2-methylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3-methyl-6-(o-tolyl)-4-[(4-p-toluoylpiperazino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C28H34N4O4 MolecularWeight: 490.59396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2C)C)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2C)C)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H34N4O4/c1-5-36-27(34)24-23(30(4)28(35)29-25(24)22-9-7-6-8-20(22)3)18-31-14-16-32(17-15-31)26(33)21-12-10-19(2)11-13-21/h6-13,25H,5,14-18H2,1-4H3,(H,29,35)