1-methyl-7-[2-(pyridin-2-ylmethylamino)pyrimidin-4-yl]oxy-indole-2-carboxylic acid

Systemtic Name: 1-methyl-7-[2-(pyridin-2-ylmethylamino)pyrimidin-4-yl]oxy-indole-2-carboxylic acid Openeye Name: 1-methyl-7-[2-(2-pyridylmethylamino)pyrimidin-4-yl]oxy-indole-2-carboxylic acid CAS Name: 1-methyl-7-[[2-(2-pyridinylmethylamino)-4-pyrimidinyl]oxy]-2-indolecarboxylic acid IUPAC Name: 1-methyl-7-[2-(pyridin-2-ylmethylamino)pyrimidin-4-yl]oxyindole-2-carboxylic acid Traditional Name: 1-methyl-7-[2-(2-pyridylmethylamino)pyrimidin-4-yl]oxy-indole-2-carboxylic acid Formula: C20H17N5O3 MolecularWeight: 375.38068

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)NCC4=CC=CC=N4)C(=O)O

Isomeric SMILES

CN1C(=CC2=C1C(=CC=C2)OC3=NC(=NC=C3)NCC4=CC=CC=N4)C(=O)O

InChI

InChI=1S/C20H17N5O3/c1-25-15(19(26)27)11-13-5-4-7-16(18(13)25)28-17-8-10-22-20(24-17)23-12-14-6-2-3-9-21-14/h2-11H,12H2,1H3,(H,26,27)(H,22,23,24)