Ethyl 3-(1H-pyrrol-1-yl)-5-(trifluoromethyl)benzo[b]thiophene-2-carboxylate

CAS Registry Number®

1227954-97-3
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CAS Name

Ethyl 3-(1H-pyrrol-1-yl)-5-(trifluoromethyl)benzo[b]thiophene-2-carboxylate

Molecular Formula

C16H12F3NO2S

Molecular Mass

339.33

Cite this Page

Ethyl 3-(1H-pyrrol-1-yl)-5-(trifluoromethyl)benzo[b]thiophene-2-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1227954-97-3 (retrieved 2024-09-10) (CAS RN: 1227954-97-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H12F3NO2S/c1-2-22-15(21)14-13(20-7-3-4-8-20)11-9-10(16(17,18)19)5-6-12(11)23-14/h3-9H,2H2,1H3

InChIKey

InChIKey=CZBMKRLZQVXKQG-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1=C(C=2C(S1)=CC=C(C(F)(F)F)C2)N3C=CC=C3

Canonical SMILES

O=C(OCC)C=1SC=2C=CC(=CC2C1N3C=CC=C3)C(F)(F)F

Other Names for this Substance

  • Benzo[b]thiophene-2-carboxylic acid, 3-(1H-pyrrol-1-yl)-5-(trifluoromethyl)-, ethyl ester
  • Ethyl 3-(1H-pyrrol-1-yl)-5-(trifluoromethyl)benzo[b]thiophene-2-carboxylate