methyl 5-bromanyl-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-bromanyl-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-thiophene-3-carboxylate Openeye Name: methyl 5-bromo-4-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]thiophene-3-carboxylate CAS Name: 5-bromo-4-[[5-(trifluoromethyl)-2-pyridinyl]thio]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylthiophene-3-carboxylate Traditional Name: 5-bromo-4-[[5-(trifluoromethyl)-2-pyridyl]thio]thiophene-3-carboxylic acid methyl ester Formula: C12H7BrF3NO2S2 MolecularWeight: 398.21869

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=C1SC2=NC=C(C=C2)C(F)(F)F)Br

Isomeric SMILES

COC(=O)C1=CSC(=C1SC2=NC=C(C=C2)C(F)(F)F)Br

InChI

InChI=1S/C12H7BrF3NO2S2/c1-19-11(18)7-5-20-10(13)9(7)21-8-3-2-6(4-17-8)12(14,15)16/h2-5H,1H3