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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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