3-tert-butyl-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-4-carboxylic acid

Systemtic Name: 3-tert-butyl-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-4-carboxylic acid Openeye Name: 3-tert-butyl-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-4-carboxylic acid CAS Name: 3-tert-butyl-1-(4,6-dimethyl-2-pyrimidinyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-tert-butyl-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-4-carboxylic acid Traditional Name: 3-tert-butyl-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-4-carboxylic acid Formula: C14H18N4O2 MolecularWeight: 274.31832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=C(C(=N2)C(C)(C)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=C(C(=N2)C(C)(C)C)C(=O)O)C

InChI

InChI=1S/C14H18N4O2/c1-8-6-9(2)16-13(15-8)18-7-10(12(19)20)11(17-18)14(3,4)5/h6-7H,1-5H3,(H,19,20)