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

Systemtic Name: 1-(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)-5-(2-methylpropyl)pyrazole-3-carboxylic acid Openeye Name: 5-isobutyl-1-(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)pyrazole-3-carboxylic acid CAS Name: 1-(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)-5-(2-methylpropyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)-5-(2-methylpropyl)pyrazole-3-carboxylic acid Traditional Name: 5-isobutyl-1-(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)pyrazole-3-carboxylic acid Formula: C12H15N5O3 MolecularWeight: 277.2792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)N2C(=CC(=N2)C(=O)O)CC(C)C

Isomeric SMILES

CC1=NNC(=NC1=O)N2C(=CC(=N2)C(=O)O)CC(C)C

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)