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

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(4-methoxyphenyl)-1-phenyl-4-pyrazolecarboxylic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(4-methoxyphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(4-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C27H22N4O4 MolecularWeight: 466.48798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O4/c1-17(25-28-23-11-7-6-10-21(23)26(32)29-25)35-27(33)22-16-31(19-8-4-3-5-9-19)30-24(22)18-12-14-20(34-2)15-13-18/h3-17H,1-2H3,(H,28,29,32)