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

Systemtic Name: 2-methyl-2-[2-methyl-4-[[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]methylsulfanyl]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[2-methyl-4-[[3-(p-tolyl)-1,2,4-thiadiazol-5-yl]methylsulfanyl]phenoxy]propanoic acid CAS Name: 2-methyl-2-[2-methyl-4-[[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]methylthio]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[2-methyl-4-[[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]methylsulfanyl]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[2-methyl-4-[[3-(p-tolyl)-1,2,4-thiadiazol-5-yl]methylthio]phenoxy]propionic acid Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NSC(=N2)CSC3=CC(=C(C=C3)OC(C)(C)C(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NSC(=N2)CSC3=CC(=C(C=C3)OC(C)(C)C(=O)O)C

InChI

InChI=1S/C21H22N2O3S2/c1-13-5-7-15(8-6-13)19-22-18(28-23-19)12-27-16-9-10-17(14(2)11-16)26-21(3,4)20(24)25/h5-11H,12H2,1-4H3,(H,24,25)