methyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxylate Openeye Name: methyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,4-dioxo-1H-quinazoline-7-carboxylate CAS Name: 3-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2,4-dioxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2,4-dioxo-1H-quinazoline-7-carboxylate Traditional Name: 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2,4-diketo-1H-quinazoline-7-carboxylic acid methyl ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN3C(=O)C4=C(C=C(C=C4)C(=O)OC)NC3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN3C(=O)C4=C(C=C(C=C4)C(=O)OC)NC3=O

InChI

InChI=1S/C22H20N4O4/c1-13-18(14(2)26(24-13)16-7-5-4-6-8-16)12-25-20(27)17-10-9-15(21(28)30-3)11-19(17)23-22(25)29/h4-11H,12H2,1-3H3,(H,23,29)