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

Systemtic Name: ethyl 6-(2,4-dichlorophenyl)-3-ethyl-2-oxidanylidene-4-[(4-propanoylpiperazin-1-yl)methyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(2,4-dichlorophenyl)-3-ethyl-2-oxo-4-[(4-propanoylpiperazin-1-yl)methyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(2,4-dichlorophenyl)-3-ethyl-2-oxo-4-[[4-(1-oxopropyl)-1-piperazinyl]methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2,4-dichlorophenyl)-3-ethyl-2-oxo-4-[(4-propanoylpiperazin-1-yl)methyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(2,4-dichlorophenyl)-3-ethyl-2-keto-4-[(4-propionylpiperazino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H30Cl2N4O4 MolecularWeight: 497.4147

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)CC2=C(C(NC(=O)N2CC)C3=C(C=C(C=C3)Cl)Cl)C(=O)OCC

Isomeric SMILES

CCC(=O)N1CCN(CC1)CC2=C(C(NC(=O)N2CC)C3=C(C=C(C=C3)Cl)Cl)C(=O)OCC

InChI

InChI=1S/C23H30Cl2N4O4/c1-4-19(30)28-11-9-27(10-12-28)14-18-20(22(31)33-6-3)21(26-23(32)29(18)5-2)16-8-7-15(24)13-17(16)25/h7-8,13,21H,4-6,9-12,14H2,1-3H3,(H,26,32)