5-[2-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-3-[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazolidin-3-yl]-3a,6a-dihydro-4H-pyrrolo[3,4-d]isoxazole-4,6(5H)-dione

CAS Registry Number®

317822-54-1
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CAS Name

5-[2-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-3-[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazolidin-3-yl]-3a,6a-dihydro-4H-pyrrolo[3,4-d]isoxazole-4,6(5H)-dione

Molecular Formula

C22H17Cl3F3N7O4

Molecular Mass

606.77

Cite this Page

5-[2-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-3-[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazolidin-3-yl]-3a,6a-dihydro-4H-pyrrolo[3,4-d]isoxazole-4,6(5H)-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=317822-54-1 (retrieved 2024-08-26) (CAS RN: 317822-54-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H17Cl3F3N7O4/c1-21(31-20(38)35(33-21)13-3-2-10(23)7-11(13)24)16-14-15(39-32-16)19(37)34(18(14)36)5-4-29-17-12(25)6-9(8-30-17)22(26,27)28/h2-3,6-8,14-15,33H,4-5H2,1H3,(H,29,30)(H,31,38)

InChIKey

InChIKey=PBCOIJSATMQQKO-UHFFFAOYSA-N

SMILES

O=C1C2C(=NOC2C(=O)N1CCNC3=C(Cl)C=C(C(F)(F)F)C=N3)C4(C)NN(C(=O)N4)C5=C(Cl)C=C(Cl)C=C5

Canonical SMILES

O=C1NC(NN1C2=CC=C(Cl)C=C2Cl)(C3=NOC4C(=O)N(C(=O)C34)CCNC5=NC=C(C=C5Cl)C(F)(F)F)C

Other Names for this Substance

  • 4H-Pyrrolo[3,4-d]isoxazole-4,6(5H)-dione, 5-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-3-[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazolidin-3-yl]-3a,6a-dihydro-
  • 5-[2-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-3-[1-(2,4-dichlorophenyl)-3-methyl-5-oxo-1,2,4-triazolidin-3-yl]-3a,6a-dihydro-4H-pyrrolo[3,4-d]isoxazole-4,6(5H)-dione