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Substance Name: 4(1H)-Pyridazinone, 3-(2-(dimethylamino)ethoxy)-6-methyl-1-(3-(trifluoromethyl)phenyl)-, (E)-2-butenedioate (1:1)
RN: 147238-35-5
InChIKey: LRHFHEVUQKTRAJ-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H18-F3-N3-O2.C4-H4-O4

Molecular Weight

  • 457.4028
 
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Names and Synonyms

Synonym

  • 3-(2-(Dimethylamino)ethoxy)-6-methyl-1-(3-(trifluoromethyl)phenyl)-4(1H)-pyridazinone fumarate

Systematic Name

  • 4(1H)-Pyridazinone, 3-(2-(dimethylamino)ethoxy)-6-methyl-1-(3-(trifluoromethyl)phenyl)-, (E)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 147238-35-5

System Generated Number

  • 0147238355

Molecular Formulas

Molecular Formula

  • C16-H18-F3-N3-O2.C4-H4-O4

Molecular Formula Fragments

  • C16-H18-F3-N3-O2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C16H18F3N3O2.C4H4O4/c1-11-9-14(23)15(24-8-7-21(2)3)20-22(11)13-6-4-5-12(10-13)16(17,18)19;5-3(6)1-2-4(7)8/h4-6,9-10H,7-8H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

LRHFHEVUQKTRAJ-WLHGVMLRSA-N

Smiles

Cc1cc(=O)c(nn1c2cccc(c2)C(F)(F)F)OCCN(C)C.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 300mg/kg (300mg/kg)   European Patent Application. Vol. #0515257,