methyl 5-methylsulfanyl-4-[4-[3-(trifluoromethyloxy)phenyl]-1,3-thiazol-2-yl]thiophene-2-carboxylate

Systemtic Name: methyl 5-methylsulfanyl-4-[4-[3-(trifluoromethyloxy)phenyl]-1,3-thiazol-2-yl]thiophene-2-carboxylate Openeye Name: methyl 5-methylsulfanyl-4-[4-[3-(trifluoromethoxy)phenyl]thiazol-2-yl]thiophene-2-carboxylate CAS Name: 5-(methylthio)-4-[4-[3-(trifluoromethoxy)phenyl]-2-thiazolyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methylsulfanyl-4-[4-[3-(trifluoromethoxy)phenyl]-1,3-thiazol-2-yl]thiophene-2-carboxylate Traditional Name: 5-(methylthio)-4-[4-[3-(trifluoromethoxy)phenyl]thiazol-2-yl]thiophene-2-carboxylic acid methyl ester Formula: C17H12F3NO3S3 MolecularWeight: 431.47229

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)C2=NC(=CS2)C3=CC(=CC=C3)OC(F)(F)F

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)C2=NC(=CS2)C3=CC(=CC=C3)OC(F)(F)F

InChI

InChI=1S/C17H12F3NO3S3/c1-23-15(22)13-7-11(16(25-2)27-13)14-21-12(8-26-14)9-4-3-5-10(6-9)24-17(18,19)20/h3-8H,1-2H3