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

Systemtic Name: ethyl 3-methyl-4-[[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl]-2-oxidanylidene-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-isopropylphenyl)-3-methyl-4-[[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-methyl-4-[[3-methyl-4-[oxo(propylamino)methyl]-1-piperazinyl]methyl]-2-oxo-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-[[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl]-2-oxo-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3-methyl-4-[[3-methyl-4-(propylcarbamoyl)piperazino]methyl]-6-p-cumenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C27H41N5O4 MolecularWeight: 499.64554

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCN(CC1C)CC2=C(C(NC(=O)N2C)C3=CC=C(C=C3)C(C)C)C(=O)OCC

Isomeric SMILES

CCCNC(=O)N1CCN(CC1C)CC2=C(C(NC(=O)N2C)C3=CC=C(C=C3)C(C)C)C(=O)OCC

InChI

InChI=1S/C27H41N5O4/c1-7-13-28-26(34)32-15-14-31(16-19(32)5)17-22-23(25(33)36-8-2)24(29-27(35)30(22)6)21-11-9-20(10-12-21)18(3)4/h9-12,18-19,24H,7-8,13-17H2,1-6H3,(H,28,34)(H,29,35)