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

Systemtic Name: ethyl 4-(3-chlorophenyl)-2-(4-ethylpiperazin-1-yl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3-chlorophenyl)-2-(4-ethylpiperazin-1-yl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(3-chlorophenyl)-2-(4-ethyl-1-piperazinyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-chlorophenyl)-2-(4-ethylpiperazin-1-yl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(3-chlorophenyl)-2-(4-ethylpiperazino)-6-keto-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H25ClN4O3 MolecularWeight: 392.8798

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(C(C(=O)N2)C(=O)OCC)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC(C(C(=O)N2)C(=O)OCC)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H25ClN4O3/c1-3-23-8-10-24(11-9-23)19-21-16(13-6-5-7-14(20)12-13)15(17(25)22-19)18(26)27-4-2/h5-7,12,15-16H,3-4,8-11H2,1-2H3,(H,21,22,25)