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

Systemtic Name: ethyl 4-[(4-cyclopentylcarbonylpiperazin-1-yl)methyl]-3-ethyl-6-(4-methylphenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[[4-(cyclopentanecarbonyl)piperazin-1-yl]methyl]-3-ethyl-2-oxo-6-(p-tolyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[4-[cyclopentyl(oxo)methyl]-1-piperazinyl]methyl]-3-ethyl-6-(4-methylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(cyclopentanecarbonyl)piperazin-1-yl]methyl]-3-ethyl-6-(4-methylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[[4-(cyclopentanecarbonyl)piperazino]methyl]-3-ethyl-2-keto-6-(p-tolyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C27H38N4O4 MolecularWeight: 482.61502

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C)C(=O)OCC)CN3CCN(CC3)C(=O)C4CCCC4

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C)C(=O)OCC)CN3CCN(CC3)C(=O)C4CCCC4

InChI

InChI=1S/C27H38N4O4/c1-4-31-22(18-29-14-16-30(17-15-29)25(32)21-8-6-7-9-21)23(26(33)35-5-2)24(28-27(31)34)20-12-10-19(3)11-13-20/h10-13,21,24H,4-9,14-18H2,1-3H3,(H,28,34)