1-(6-methyl-3-oxidanylidene-2H-1,2,4-triazin-5-yl)-5-(2-methylpropyl)pyrazole-3-carboxylate

Systemtic Name: 1-(6-methyl-3-oxidanylidene-2H-1,2,4-triazin-5-yl)-5-(2-methylpropyl)pyrazole-3-carboxylate Openeye Name: 5-isobutyl-1-(6-methyl-3-oxo-2H-1,2,4-triazin-5-yl)pyrazole-3-carboxylate CAS Name: 1-(6-methyl-3-oxo-2H-1,2,4-triazin-5-yl)-5-(2-methylpropyl)-3-pyrazolecarboxylate IUPAC Name: 1-(6-methyl-3-oxo-2H-1,2,4-triazin-5-yl)-5-(2-methylpropyl)pyrazole-3-carboxylate Traditional Name: 5-isobutyl-1-(3-keto-6-methyl-2H-1,2,4-triazin-5-yl)pyrazole-3-carboxylate Formula: C12H14N5O3- MolecularWeight: 276.27126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)N=C1N2C(=CC(=N2)C(=O)[O-])CC(C)C

Isomeric SMILES

CC1=NNC(=O)N=C1N2C(=CC(=N2)C(=O)[O-])CC(C)C

InChI

InChI=1S/C12H15N5O3/c1-6(2)4-8-5-9(11(18)19)16-17(8)10-7(3)14-15-12(20)13-10/h5-6H,4H2,1-3H3,(H,18,19)(H,13,15,20)/p-1