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

Systemtic Name: 1-methyl-6-[2-[(3R)-3-oxidanylpyrrolidin-1-yl]carbonylthieno[3,2-b]pyridin-7-yl]oxy-indole-3-carboxylic acid Openeye Name: 6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-methyl-indole-3-carboxylic acid CAS Name: 6-[[2-[[(3R)-3-hydroxy-1-pyrrolidinyl]-oxomethyl]-7-thieno[3,2-b]pyridinyl]oxy]-1-methyl-3-indolecarboxylic acid IUPAC Name: 6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-methylindole-3-carboxylic acid Traditional Name: 6-[2-[(3R)-3-hydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxy-1-methyl-indole-3-carboxylic acid Formula: C22H19N3O5S MolecularWeight: 437.46836

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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)O)C(=O)O

Isomeric SMILES

CN1C=C(C2=C1C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CC[C@H](C5)O)C(=O)O

InChI

InChI=1S/C22H19N3O5S/c1-24-11-15(22(28)29)14-3-2-13(8-17(14)24)30-18-4-6-23-16-9-19(31-20(16)18)21(27)25-7-5-12(26)10-25/h2-4,6,8-9,11-12,26H,5,7,10H2,1H3,(H,28,29)/t12-/m1/s1