ethyl 2,3-bis(4-fluorophenyl)-5-(trifluoromethylsulfanyl)pyrrole-1-carboxylate

Systemtic Name: ethyl 2,3-bis(4-fluorophenyl)-5-(trifluoromethylsulfanyl)pyrrole-1-carboxylate Openeye Name: ethyl 2,3-bis(4-fluorophenyl)-5-(trifluoromethylsulfanyl)pyrrole-1-carboxylate CAS Name: 2,3-bis(4-fluorophenyl)-5-(trifluoromethylthio)-1-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,3-bis(4-fluorophenyl)-5-(trifluoromethylsulfanyl)pyrrole-1-carboxylate Traditional Name: 2,3-bis(4-fluorophenyl)-5-(trifluoromethylthio)pyrrole-1-carboxylic acid ethyl ester Formula: C20H14F5NO2S MolecularWeight: 427.387676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=CC(=C1C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)SC(F)(F)F

Isomeric SMILES

CCOC(=O)N1C(=CC(=C1C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)SC(F)(F)F

InChI

InChI=1S/C20H14F5NO2S/c1-2-28-19(27)26-17(29-20(23,24)25)11-16(12-3-7-14(21)8-4-12)18(26)13-5-9-15(22)10-6-13/h3-11H,2H2,1H3