5-ethyl-1-(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)pyrazole-3-carboxylate

Systemtic Name: 5-ethyl-1-(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)pyrazole-3-carboxylate Openeye Name: 5-ethyl-1-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)pyrazole-3-carboxylate CAS Name: 5-ethyl-1-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)-3-pyrazolecarboxylate IUPAC Name: 5-ethyl-1-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)pyrazole-3-carboxylate Traditional Name: 5-ethyl-1-(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)pyrazole-3-carboxylate Formula: C14H15N4O3- MolecularWeight: 287.2939

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=NC(=O)C3=C(N2)CCCC3)C(=O)[O-]

Isomeric SMILES

CCC1=CC(=NN1C2=NC(=O)C3=C(N2)CCCC3)C(=O)[O-]

InChI

InChI=1S/C14H16N4O3/c1-2-8-7-11(13(20)21)17-18(8)14-15-10-6-4-3-5-9(10)12(19)16-14/h7H,2-6H2,1H3,(H,20,21)(H,15,16,19)/p-1