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

Systemtic Name: methyl 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indole-3-carboxylate Openeye Name: methyl 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]indole-3-carboxylate CAS Name: 1-[[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]methyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indole-3-carboxylate Traditional Name: 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]indole-3-carboxylic acid methyl ester Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C=C(C5=CC=CC=C54)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C=C(C5=CC=CC=C54)C(=O)OC

InChI

InChI=1S/C26H24N2O3S/c1-26(2,3)23-15-32-24(27-23)22-12-17-11-16(9-10-21(17)31-22)13-28-14-19(25(29)30-4)18-7-5-6-8-20(18)28/h5-12,14-15H,13H2,1-4H3