1,2-dimethyl-6-(2-pyrimidin-2-ylthieno[3,2-b]pyridin-7-yl)oxy-indole-3-carboxylic acid

Systemtic Name: 1,2-dimethyl-6-(2-pyrimidin-2-ylthieno[3,2-b]pyridin-7-yl)oxy-indole-3-carboxylic acid Openeye Name: 1,2-dimethyl-6-(2-pyrimidin-2-ylthieno[3,2-b]pyridin-7-yl)oxy-indole-3-carboxylic acid CAS Name: 1,2-dimethyl-6-[[2-(2-pyrimidinyl)-7-thieno[3,2-b]pyridinyl]oxy]-3-indolecarboxylic acid IUPAC Name: 1,2-dimethyl-6-(2-pyrimidin-2-ylthieno[3,2-b]pyridin-7-yl)oxyindole-3-carboxylic acid Traditional Name: 1,2-dimethyl-6-[2-(2-pyrimidyl)thieno[3,2-b]pyridin-7-yl]oxy-indole-3-carboxylic acid Formula: C22H16N4O3S MolecularWeight: 416.45244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C5=NC=CC=N5)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C5=NC=CC=N5)C(=O)O

InChI

InChI=1S/C22H16N4O3S/c1-12-19(22(27)28)14-5-4-13(10-16(14)26(12)2)29-17-6-9-23-15-11-18(30-20(15)17)21-24-7-3-8-25-21/h3-11H,1-2H3,(H,27,28)