ethyl 6-oxidanylidene-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-oxo-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carboxylate CAS Name: 6-oxo-2-(4-phenyl-1-piperazinyl)-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carboxylate Traditional Name: 6-keto-2-(4-phenylpiperazino)-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(NC1=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(NC1=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O3/c1-2-24-16(23)14-12-18-17(19-15(14)22)21-10-8-20(9-11-21)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3,(H,18,19,22)