1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-5-methoxy-indazole-3-carboxylic acid

Systemtic Name: 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-5-methoxy-indazole-3-carboxylic acid Openeye Name: 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]-5-methoxy-indazole-3-carboxylic acid CAS Name: 1-[[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]methyl]-5-methoxy-3-indazolecarboxylic acid IUPAC Name: 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-5-methoxyindazole-3-carboxylic acid Traditional Name: 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]-5-methoxy-indazole-3-carboxylic acid Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C5=C(C=C(C=C5)OC)C(=N4)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C5=C(C=C(C=C5)OC)C(=N4)C(=O)O

InChI

InChI=1S/C25H23N3O4S/c1-25(2,3)21-13-33-23(26-21)20-10-15-9-14(5-8-19(15)32-20)12-28-18-7-6-16(31-4)11-17(18)22(27-28)24(29)30/h5-11,13H,12H2,1-4H3,(H,29,30)