3-[[1-methyl-5-[2-(methylcarbamoyl)pyridin-4-yl]oxy-benzimidazol-2-yl]amino]benzoic acid

Systemtic Name: 3-[[1-methyl-5-[2-(methylcarbamoyl)pyridin-4-yl]oxy-benzimidazol-2-yl]amino]benzoic acid Openeye Name: 3-[[1-methyl-5-[[2-(methylcarbamoyl)-4-pyridyl]oxy]benzimidazol-2-yl]amino]benzoic acid CAS Name: 3-[[1-methyl-5-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]-2-benzimidazolyl]amino]benzoic acid IUPAC Name: 3-[[1-methyl-5-[2-(methylcarbamoyl)pyridin-4-yl]oxybenzimidazol-2-yl]amino]benzoic acid Traditional Name: 3-[[1-methyl-5-[[2-(methylcarbamoyl)-4-pyridyl]oxy]benzimidazol-2-yl]amino]benzoic acid Formula: C22H19N5O4 MolecularWeight: 417.41736

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC=CC(=C4)C(=O)O)C

Isomeric SMILES

CNC(=O)C1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC=CC(=C4)C(=O)O)C

InChI

InChI=1S/C22H19N5O4/c1-23-20(28)18-12-16(8-9-24-18)31-15-6-7-19-17(11-15)26-22(27(19)2)25-14-5-3-4-13(10-14)21(29)30/h3-12H,1-2H3,(H,23,28)(H,25,26)(H,29,30)