3-[7-[[(5-methyl-2-phenyl-1,3-thiazol-4-yl)carbonylamino]methyl]-2,3-dihydro-1-benzofuran-5-yl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[7-[[(5-methyl-2-phenyl-1,3-thiazol-4-yl)carbonylamino]methyl]-2,3-dihydro-1-benzofuran-5-yl]-2-propan-2-yloxy-propanoic acid Openeye Name: 2-isopropoxy-3-[7-[[(5-methyl-2-phenyl-thiazole-4-carbonyl)amino]methyl]-2,3-dihydrobenzofuran-5-yl]propanoic acid CAS Name: 3-[7-[[[(5-methyl-2-phenyl-4-thiazolyl)-oxomethyl]amino]methyl]-2,3-dihydrobenzofuran-5-yl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[7-[[(5-methyl-2-phenyl-1,3-thiazole-4-carbonyl)amino]methyl]-2,3-dihydro-1-benzofuran-5-yl]-2-propan-2-yloxypropanoic acid Traditional Name: 2-isopropoxy-3-[7-[[(5-methyl-2-phenyl-thiazole-4-carbonyl)amino]methyl]coumaran-5-yl]propionic acid Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2=CC=CC=C2)C(=O)NCC3=C4C(=CC(=C3)CC(C(=O)O)OC(C)C)CCO4

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=CC=C2)C(=O)NCC3=C4C(=CC(=C3)CC(C(=O)O)OC(C)C)CCO4

InChI

InChI=1S/C26H28N2O5S/c1-15(2)33-21(26(30)31)13-17-11-19-9-10-32-23(19)20(12-17)14-27-24(29)22-16(3)34-25(28-22)18-7-5-4-6-8-18/h4-8,11-12,15,21H,9-10,13-14H2,1-3H3,(H,27,29)(H,30,31)