Butyl 4-amino-3-[3-(trifluoromethyl)phenyl]-5-isothiazolecarboxylate

CAS Registry Number®

93923-94-5

CAS Name

Butyl 4-amino-3-[3-(trifluoromethyl)phenyl]-5-isothiazolecarboxylate

Molecular Formula

C15H15F3N2O2S

Molecular Mass

344.35

Cite this Page

Butyl 4-amino-3-[3-(trifluoromethyl)phenyl]-5-isothiazolecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=93923-94-5 (retrieved 2024-12-23) (CAS RN: 93923-94-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H15F3N2O2S/c1-2-3-7-22-14(21)13-11(19)12(20-23-13)9-5-4-6-10(8-9)15(16,17)18/h4-6,8H,2-3,7,19H2,1H3

InChIKey

InChIKey=RZQNJAZKCZDNHY-UHFFFAOYSA-N

SMILES

NC=1C(=NSC1C(OCCCC)=O)C2=CC(C(F)(F)F)=CC=C2

Canonical SMILES

O=C(OCCCC)C=1SN=C(C=2C=CC=C(C2)C(F)(F)F)C1N

Other Names for this Substance

  • 5-Isothiazolecarboxylic acid, 4-amino-3-[3-(trifluoromethyl)phenyl]-, butyl ester
  • Butyl 4-amino-3-[3-(trifluoromethyl)phenyl]-5-isothiazolecarboxylate

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