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

Systemtic Name: ethyl 6-(4-chlorophenyl)-3-methyl-4-[(3-methyl-4-propanoyl-piperazin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-chlorophenyl)-3-methyl-4-[(3-methyl-4-propanoyl-piperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-chlorophenyl)-3-methyl-4-[[3-methyl-4-(1-oxopropyl)-1-piperazinyl]methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-chlorophenyl)-3-methyl-4-[(3-methyl-4-propanoylpiperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-chlorophenyl)-2-keto-3-methyl-4-[(3-methyl-4-propionyl-piperazino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H31ClN4O4 MolecularWeight: 462.96964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31ClN4O4/c1-5-19(29)28-12-11-27(13-15(28)3)14-18-20(22(30)32-6-2)21(25-23(31)26(18)4)16-7-9-17(24)10-8-16/h7-10,15,21H,5-6,11-14H2,1-4H3,(H,25,31)