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

Systemtic Name: ethyl 5-(2-deuterio-4-oxidanylidene-quinazolin-3-yl)-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(2-deuterio-4-oxo-quinazolin-3-yl)-1-methyl-pyrazole-4-carboxylate CAS Name: 5-(2-deuterio-4-oxo-3-quinazolinyl)-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-deuterio-4-oxoquinazolin-3-yl)-1-methylpyrazole-4-carboxylate Traditional Name: 5-(2-deuterio-4-keto-quinazolin-3-yl)-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C15H14N4O3 MolecularWeight: 299.302822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

[2H]C1=NC2=CC=CC=C2C(=O)N1C3=C(C=NN3C)C(=O)OCC

InChI

InChI=1S/C15H14N4O3/c1-3-22-15(21)11-8-17-18(2)13(11)19-9-16-12-7-5-4-6-10(12)14(19)20/h4-9H,3H2,1-2H3/i9D