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

Systemtic Name: ethyl 3-ethyl-4-[[3-methyl-4-(4-methylphenyl)carbonyl-piperazin-1-yl]methyl]-2-oxidanylidene-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-ethyl-6-(4-isopropylphenyl)-4-[[3-methyl-4-(4-methylbenzoyl)piperazin-1-yl]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-4-[[3-methyl-4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]methyl]-2-oxo-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-4-[[3-methyl-4-(4-methylbenzoyl)piperazin-1-yl]methyl]-2-oxo-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-2-keto-4-[(3-methyl-4-p-toluoyl-piperazino)methyl]-6-p-cumenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C32H42N4O4 MolecularWeight: 546.70028

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C(C)C)C(=O)OCC)CN3CCN(C(C3)C)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C(C)C)C(=O)OCC)CN3CCN(C(C3)C)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C32H42N4O4/c1-7-35-27(20-34-17-18-36(23(6)19-34)30(37)26-11-9-22(5)10-12-26)28(31(38)40-8-2)29(33-32(35)39)25-15-13-24(14-16-25)21(3)4/h9-16,21,23,29H,7-8,17-20H2,1-6H3,(H,33,39)