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

Systemtic Name: 1-(6-methyl-5-oxidanidyl-1,2,4-triazin-3-yl)-5-(2-methylpropyl)pyrazole-3-carboxylate Openeye Name: 5-isobutyl-1-(6-methyl-5-oxido-1,2,4-triazin-3-yl)pyrazole-3-carboxylate CAS Name: 1-(6-methyl-5-oxido-1,2,4-triazin-3-yl)-5-(2-methylpropyl)-3-pyrazolecarboxylate IUPAC Name: 1-(6-methyl-5-oxido-1,2,4-triazin-3-yl)-5-(2-methylpropyl)pyrazole-3-carboxylate Traditional Name: 5-isobutyl-1-(6-methyl-5-oxido-1,2,4-triazin-3-yl)pyrazole-3-carboxylate Formula: C12H13N5O3-2 MolecularWeight: 275.26332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)N2C(=CC(=N2)C(=O)[O-])CC(C)C)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)N2C(=CC(=N2)C(=O)[O-])CC(C)C)[O-]

InChI

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