4-[5-fluoranyl-2-[(1-methylindazol-5-yl)amino]pyrimidin-4-yl]benzoic acid

Systemtic Name: 4-[5-fluoranyl-2-[(1-methylindazol-5-yl)amino]pyrimidin-4-yl]benzoic acid Openeye Name: 4-[5-fluoro-2-[(1-methylindazol-5-yl)amino]pyrimidin-4-yl]benzoic acid CAS Name: 4-[5-fluoro-2-[(1-methyl-5-indazolyl)amino]-4-pyrimidinyl]benzoic acid IUPAC Name: 4-[5-fluoro-2-[(1-methylindazol-5-yl)amino]pyrimidin-4-yl]benzoic acid Traditional Name: 4-[5-fluoro-2-[(1-methylindazol-5-yl)amino]pyrimidin-4-yl]benzoic acid Formula: C19H14FN5O2 MolecularWeight: 363.345163

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC3=NC=C(C(=N3)C4=CC=C(C=C4)C(=O)O)F)C=N1

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC3=NC=C(C(=N3)C4=CC=C(C=C4)C(=O)O)F)C=N1

InChI

InChI=1S/C19H14FN5O2/c1-25-16-7-6-14(8-13(16)9-22-25)23-19-21-10-15(20)17(24-19)11-2-4-12(5-3-11)18(26)27/h2-10H,1H3,(H,26,27)(H,21,23,24)