methyl 1-[2-methylsulfanyl-5-(trifluoromethyl)phenyl]pyrrole-2-carboxylate

Systemtic Name: methyl 1-[2-methylsulfanyl-5-(trifluoromethyl)phenyl]pyrrole-2-carboxylate Openeye Name: methyl 1-[2-methylsulfanyl-5-(trifluoromethyl)phenyl]pyrrole-2-carboxylate CAS Name: 1-[2-(methylthio)-5-(trifluoromethyl)phenyl]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-methylsulfanyl-5-(trifluoromethyl)phenyl]pyrrole-2-carboxylate Traditional Name: 1-[2-(methylthio)-5-(trifluoromethyl)phenyl]pyrrole-2-carboxylic acid methyl ester Formula: C14H12F3NO2S MolecularWeight: 315.31079

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CN1C2=C(C=CC(=C2)C(F)(F)F)SC

Isomeric SMILES

COC(=O)C1=CC=CN1C2=C(C=CC(=C2)C(F)(F)F)SC

InChI

InChI=1S/C14H12F3NO2S/c1-20-13(19)10-4-3-7-18(10)11-8-9(14(15,16)17)5-6-12(11)21-2/h3-8H,1-2H3