2-[1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indol-3-yl]ethanoic acid Openeye Name: 2-[1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]indol-3-yl]acetic acid CAS Name: 2-[1-[[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]methyl]-3-indolyl]acetic acid IUPAC Name: 2-[1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indol-3-yl]acetic acid Traditional Name: 2-[1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]indol-3-yl]acetic acid 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)CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C26H24N2O3S/c1-26(2,3)23-15-32-25(27-23)22-11-17-10-16(8-9-21(17)31-22)13-28-14-18(12-24(29)30)19-6-4-5-7-20(19)28/h4-11,14-15H,12-13H2,1-3H3,(H,29,30)