2-(1-cyano-4-methyl-5-oxidanylidene-4-propan-2-yl-imidazol-2-yl)pyridine-3-carboxylic acid

Systemtic Name: 2-(1-cyano-4-methyl-5-oxidanylidene-4-propan-2-yl-imidazol-2-yl)pyridine-3-carboxylic acid Openeye Name: 2-(1-cyano-4-isopropyl-4-methyl-5-oxo-imidazol-2-yl)pyridine-3-carboxylic acid CAS Name: 2-(1-cyano-4-methyl-5-oxo-4-propan-2-yl-2-imidazolyl)-3-pyridinecarboxylic acid IUPAC Name: 2-(1-cyano-4-methyl-5-oxo-4-propan-2-ylimidazol-2-yl)pyridine-3-carboxylic acid Traditional Name: 2-(1-cyano-4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)nicotinic acid Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)N(C(=N1)C2=C(C=CC=N2)C(=O)O)C#N)C

Isomeric SMILES

CC(C)C1(C(=O)N(C(=N1)C2=C(C=CC=N2)C(=O)O)C#N)C

InChI

InChI=1S/C14H14N4O3/c1-8(2)14(3)13(21)18(7-15)11(17-14)10-9(12(19)20)5-4-6-16-10/h4-6,8H,1-3H3,(H,19,20)