methyl 2,4-bis(oxidanylidene)-3-(1-pyrazol-1-ylpropan-2-yl)-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2,4-bis(oxidanylidene)-3-(1-pyrazol-1-ylpropan-2-yl)-1H-quinazoline-7-carboxylate Openeye Name: methyl 3-(1-methyl-2-pyrazol-1-yl-ethyl)-2,4-dioxo-1H-quinazoline-7-carboxylate CAS Name: 2,4-dioxo-3-[1-(1-pyrazolyl)propan-2-yl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dioxo-3-(1-pyrazol-1-ylpropan-2-yl)-1H-quinazoline-7-carboxylate Traditional Name: 2,4-diketo-3-(1-methyl-2-pyrazol-1-yl-ethyl)-1H-quinazoline-7-carboxylic acid methyl ester Formula: C16H16N4O4 MolecularWeight: 328.32264

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=CC=N1)N2C(=O)C3=C(C=C(C=C3)C(=O)OC)NC2=O

Isomeric SMILES

CC(CN1C=CC=N1)N2C(=O)C3=C(C=C(C=C3)C(=O)OC)NC2=O

InChI

InChI=1S/C16H16N4O4/c1-10(9-19-7-3-6-17-19)20-14(21)12-5-4-11(15(22)24-2)8-13(12)18-16(20)23/h3-8,10H,9H2,1-2H3,(H,18,23)