2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-6-methyl-pyridine-3-carboxylic acid

Systemtic Name: 2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-6-methyl-pyridine-3-carboxylic acid Openeye Name: 2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-6-methyl-pyridine-3-carboxylic acid CAS Name: 2-[[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]amino]-6-methyl-3-pyridinecarboxylic acid IUPAC Name: 2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-6-methylpyridine-3-carboxylic acid Traditional Name: 2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-6-methyl-nicotinic acid Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)O)NC2=CC(=NN2C3=CC=CC=C3C)C(C)(C)C

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)O)NC2=CC(=NN2C3=CC=CC=C3C)C(C)(C)C

InChI

InChI=1S/C21H24N4O2/c1-13-8-6-7-9-16(13)25-18(12-17(24-25)21(3,4)5)23-19-15(20(26)27)11-10-14(2)22-19/h6-12H,1-5H3,(H,22,23)(H,26,27)