2-methyl-6-[2-(pyrrolidin-1-ylmethyl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxylic acid Openeye Name: 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)thieno[3,2-b]pyridin-7-yl]oxy-benzothiophene-3-carboxylic acid CAS Name: 2-methyl-6-[[2-(1-pyrrolidinylmethyl)-7-thieno[3,2-b]pyridinyl]oxy]-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-methyl-6-[2-(pyrrolidin-1-ylmethyl)thieno[3,2-b]pyridin-7-yl]oxy-1-benzothiophene-3-carboxylic acid Traditional Name: 2-methyl-6-[2-(pyrrolidinomethyl)thieno[3,2-b]pyridin-7-yl]oxy-benzothiophene-3-carboxylic acid Formula: C22H20N2O3S2 MolecularWeight: 424.5358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)CN5CCCC5)C(=O)O

Isomeric SMILES

CC1=C(C2=C(S1)C=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)CN5CCCC5)C(=O)O

InChI

InChI=1S/C22H20N2O3S2/c1-13-20(22(25)26)16-5-4-14(10-19(16)28-13)27-18-6-7-23-17-11-15(29-21(17)18)12-24-8-2-3-9-24/h4-7,10-11H,2-3,8-9,12H2,1H3,(H,25,26)