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

Systemtic Name: 6-[2-(3-methoxypyrrolidin-1-yl)carbonylthieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxylic acid Openeye Name: 2-isopropyl-6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-benzofuran-3-carboxylic acid CAS Name: 6-[[2-[(3-methoxy-1-pyrrolidinyl)-oxomethyl]-7-thieno[3,2-b]pyridinyl]oxy]-2-propan-2-yl-3-benzofurancarboxylic acid IUPAC Name: 6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-2-propan-2-yl-1-benzofuran-3-carboxylic acid Traditional Name: 2-isopropyl-6-[2-(3-methoxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-benzofuran-3-carboxylic acid Formula: C25H24N2O6S MolecularWeight: 480.53286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=C(O1)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CCC(C5)OC)C(=O)O

Isomeric SMILES

CC(C)C1=C(C2=C(O1)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CCC(C5)OC)C(=O)O

InChI

InChI=1S/C25H24N2O6S/c1-13(2)22-21(25(29)30)16-5-4-14(10-19(16)33-22)32-18-6-8-26-17-11-20(34-23(17)18)24(28)27-9-7-15(12-27)31-3/h4-6,8,10-11,13,15H,7,9,12H2,1-3H3,(H,29,30)