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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=CC(=N2)C(C)(C)C)NC3=C(C=CC=N3)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=CC(=N2)C(C)(C)C)NC3=C(C=CC=N3)C(=O)O

InChI

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