ethyl 5-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(2-ethyl-4-oxo-quinazolin-3-yl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(2-ethyl-4-oxo-3-quinazolinyl)-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-ethyl-4-oxoquinazolin-3-yl)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-(2-ethyl-4-keto-quinazolin-3-yl)-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=O)N1C3=C(C=NN3C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=O)N1C3=C(C=NN3C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C22H20N4O3/c1-3-19-24-18-13-9-8-12-16(18)21(27)25(19)20-17(22(28)29-4-2)14-23-26(20)15-10-6-5-7-11-15/h5-14H,3-4H2,1-2H3