2-[2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-methyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-methyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-4-methyl-thiazol-5-yl]acetic acid CAS Name: 2-[2-[(3-fluoro-4-methoxyphenyl)methylthio]-4-methyl-5-thiazolyl]acetic acid IUPAC Name: 2-[2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-4-methyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-[(3-fluoro-4-methoxy-benzyl)thio]-4-methyl-thiazol-5-yl]acetic acid Formula: C14H14FNO3S2 MolecularWeight: 327.394263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC2=CC(=C(C=C2)OC)F)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCC2=CC(=C(C=C2)OC)F)CC(=O)O

InChI

InChI=1S/C14H14FNO3S2/c1-8-12(6-13(17)18)21-14(16-8)20-7-9-3-4-11(19-2)10(15)5-9/h3-5H,6-7H2,1-2H3,(H,17,18)