4-fluoranyl-2-methyl-5-[2-(3-oxidanylpyrrolidin-1-yl)carbonylthieno[3,2-b]pyridin-7-yl]oxy-indole-1-carboxylic acid

Systemtic Name: 4-fluoranyl-2-methyl-5-[2-(3-oxidanylpyrrolidin-1-yl)carbonylthieno[3,2-b]pyridin-7-yl]oxy-indole-1-carboxylic acid Openeye Name: 4-fluoro-5-[2-(3-hydroxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-2-methyl-indole-1-carboxylic acid CAS Name: 4-fluoro-5-[[2-[(3-hydroxy-1-pyrrolidinyl)-oxomethyl]-7-thieno[3,2-b]pyridinyl]oxy]-2-methyl-1-indolecarboxylic acid IUPAC Name: 4-fluoro-5-[2-(3-hydroxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-2-methylindole-1-carboxylic acid Traditional Name: 4-fluoro-5-[2-(3-hydroxypyrrolidine-1-carbonyl)thieno[3,2-b]pyridin-7-yl]oxy-2-methyl-indole-1-carboxylic acid Formula: C22H18FN3O5S MolecularWeight: 455.458823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C(=O)O)C=CC(=C2F)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CCC(C5)O

Isomeric SMILES

CC1=CC2=C(N1C(=O)O)C=CC(=C2F)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CCC(C5)O

InChI

InChI=1S/C22H18FN3O5S/c1-11-8-13-15(26(11)22(29)30)2-3-16(19(13)23)31-17-4-6-24-14-9-18(32-20(14)17)21(28)25-7-5-12(27)10-25/h2-4,6,8-9,12,27H,5,7,10H2,1H3,(H,29,30)