ethyl 4-(3-chlorophenyl)-2-(4-methylpiperazin-1-yl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(3-chlorophenyl)-2-(4-methylpiperazin-1-yl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3-chlorophenyl)-2-(4-methylpiperazin-1-yl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(3-chlorophenyl)-2-(4-methyl-1-piperazinyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-chlorophenyl)-2-(4-methylpiperazin-1-yl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(3-chlorophenyl)-6-keto-2-(4-methylpiperazino)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H23ClN4O3 MolecularWeight: 378.85322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H23ClN4O3/c1-3-26-17(25)14-15(12-5-4-6-13(19)11-12)20-18(21-16(14)24)23-9-7-22(2)8-10-23/h4-6,11,14-15H,3,7-10H2,1-2H3,(H,20,21,24)