2-[3-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl]-1-benzofuran-5-yl]-2-methylsulfanyl-propanoic acid

Systemtic Name: 2-[3-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl]-1-benzofuran-5-yl]-2-methylsulfanyl-propanoic acid Openeye Name: 2-[3-[[5-methyl-2-(m-tolyl)oxazol-4-yl]methyl]benzofuran-5-yl]-2-methylsulfanyl-propanoic acid CAS Name: 2-[3-[[5-methyl-2-(3-methylphenyl)-4-oxazolyl]methyl]-5-benzofuranyl]-2-(methylthio)propanoic acid IUPAC Name: 2-[3-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl]-1-benzofuran-5-yl]-2-methylsulfanylpropanoic acid Traditional Name: 2-[3-[[5-methyl-2-(m-tolyl)oxazol-4-yl]methyl]benzofuran-5-yl]-2-(methylthio)propionic acid Formula: C24H23NO4S MolecularWeight: 421.50872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(O2)C)CC3=COC4=C3C=C(C=C4)C(C)(C(=O)O)SC

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(O2)C)CC3=COC4=C3C=C(C=C4)C(C)(C(=O)O)SC

InChI

InChI=1S/C24H23NO4S/c1-14-6-5-7-16(10-14)22-25-20(15(2)29-22)11-17-13-28-21-9-8-18(12-19(17)21)24(3,30-4)23(26)27/h5-10,12-13H,11H2,1-4H3,(H,26,27)