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

Systemtic Name: 2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-5-fluoranyl-pyridine-3-carboxylic acid Openeye Name: 2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-5-fluoro-pyridine-3-carboxylic acid CAS Name: 2-[[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]amino]-5-fluoro-3-pyridinecarboxylic acid IUPAC Name: 2-[[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]amino]-5-fluoropyridine-3-carboxylic acid Traditional Name: 2-[[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]amino]-5-fluoro-nicotinic acid Formula: C20H21FN4O2 MolecularWeight: 368.404743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC3=NC=C(C=C3C(=O)O)F

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC3=NC=C(C=C3C(=O)O)F

InChI

InChI=1S/C20H21FN4O2/c1-12-7-5-6-8-15(12)25-17(10-16(24-25)20(2,3)4)23-18-14(19(26)27)9-13(21)11-22-18/h5-11H,1-4H3,(H,22,23)(H,26,27)