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

Systemtic Name: 6-[2-(3-methoxypyrrolidin-1-yl)carbonylthieno[3,2-b]pyridin-7-yl]oxy-1-methyl-indole-3-carboxylic acid Openeye Name: 6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-1-methyl-indole-3-carboxylic acid CAS Name: 6-[[2-[(3-methoxy-1-pyrrolidinyl)-oxomethyl]-7-thieno[3,2-b]pyridinyl]oxy]-1-methyl-3-indolecarboxylic acid IUPAC Name: 6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-1-methylindole-3-carboxylic acid Traditional Name: 6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-1-methyl-indole-3-carboxylic acid Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CCC(C5)OC)C(=O)O

Isomeric SMILES

CN1C=C(C2=C1C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CCC(C5)OC)C(=O)O

InChI

InChI=1S/C23H21N3O5S/c1-25-12-16(23(28)29)15-4-3-13(9-18(15)25)31-19-5-7-24-17-10-20(32-21(17)19)22(27)26-8-6-14(11-26)30-2/h3-5,7,9-10,12,14H,6,8,11H2,1-2H3,(H,28,29)