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

Systemtic Name: 1,2-dimethyl-6-[2-(3-oxidanylazetidin-1-yl)carbonylthieno[3,2-b]pyridin-7-yl]oxy-indole-3-carboxylic acid Openeye Name: 6-[2-(3-hydroxyazetidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-1,2-dimethyl-indole-3-carboxylic acid CAS Name: 6-[[2-[(3-hydroxy-1-azetidinyl)-oxomethyl]-7-thieno[3,2-b]pyridinyl]oxy]-1,2-dimethyl-3-indolecarboxylic acid IUPAC Name: 6-[2-(3-hydroxyazetidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-1,2-dimethylindole-3-carboxylic acid Traditional Name: 6-[2-(3-hydroxyazetidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-1,2-dimethyl-indole-3-carboxylic acid Formula: C22H19N3O5S MolecularWeight: 437.46836

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)C(=O)N5CC(C5)O)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CC(C5)O)C(=O)O

InChI

InChI=1S/C22H19N3O5S/c1-11-19(22(28)29)14-4-3-13(7-16(14)24(11)2)30-17-5-6-23-15-8-18(31-20(15)17)21(27)25-9-12(26)10-25/h3-8,12,26H,9-10H2,1-2H3,(H,28,29)