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

Systemtic Name: 2-(1-cyano-4-methyl-5-oxidanylidene-4-propan-2-yl-imidazol-2-yl)-5-ethyl-pyridine-3-carboxylic acid Openeye Name: 2-(1-cyano-4-isopropyl-4-methyl-5-oxo-imidazol-2-yl)-5-ethyl-pyridine-3-carboxylic acid CAS Name: 2-(1-cyano-4-methyl-5-oxo-4-propan-2-yl-2-imidazolyl)-5-ethyl-3-pyridinecarboxylic acid IUPAC Name: 2-(1-cyano-4-methyl-5-oxo-4-propan-2-ylimidazol-2-yl)-5-ethylpyridine-3-carboxylic acid Traditional Name: 2-(1-cyano-4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-5-ethyl-nicotinic acid Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C(=C1)C(=O)O)C2=NC(C(=O)N2C#N)(C)C(C)C

Isomeric SMILES

CCC1=CN=C(C(=C1)C(=O)O)C2=NC(C(=O)N2C#N)(C)C(C)C

InChI

InChI=1S/C16H18N4O3/c1-5-10-6-11(14(21)22)12(18-7-10)13-19-16(4,9(2)3)15(23)20(13)8-17/h6-7,9H,5H2,1-4H3,(H,21,22)