(phenylmethyl) 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indazole-3-carboxylate

Systemtic Name: (phenylmethyl) 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indazole-3-carboxylate Openeye Name: benzyl 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]indazole-3-carboxylate CAS Name: 1-[[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]methyl]-3-indazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indazole-3-carboxylate Traditional Name: 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]indazole-3-carboxylic acid benzyl ester Formula: C31H27N3O3S MolecularWeight: 521.62938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C5=CC=CC=C5C(=N4)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C5=CC=CC=C5C(=N4)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C31H27N3O3S/c1-31(2,3)27-19-38-29(32-27)26-16-22-15-21(13-14-25(22)37-26)17-34-24-12-8-7-11-23(24)28(33-34)30(35)36-18-20-9-5-4-6-10-20/h4-16,19H,17-18H2,1-3H3