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Substance Name: AG 2000
RN: 111712-16-4
InChIKey: UIMBHWFFFJEBSC-UHFFFAOYSA-J

Molecular Formula

  • C16-H13-F3-N3-O-S.B-F4

Molecular Weight

  • 439.162
 
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Names and Synonyms

Name of Substance

  • AG 2000

Synonyms

  • 4-Methyl-3-(2,2,2-trifluoroethoxy)-5H-pyrido(1',2'-4,5)(1,2,,4)thiadiazino-(2,3-a)benzimidazol-13-ium
  • AG-2000

Systematic Name

  • 5H-Pyrido(1',2':4,5)(1,2,4)thiadiazino(2,3-a)benzimidazol-13-ium, 4-methyl-3-(2,2,2-trifluoroethoxy)-, tetrafluoroborate(1-)

Registry Numbers

CAS Registry Number

  • 111712-16-4

System Generated Number

  • 0111712164

Molecular Formulas

Molecular Formula

  • C16-H13-F3-N3-O-S.B-F4

Molecular Formula Fragments

  • B-F4
  • C16-H13-F3-N3-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C16H13F3N3OS.B.4FH/c1-10-13-8-24-22-12-5-3-2-4-11(12)20-15(22)21(13)7-6-14(10)23-9-16(17,18)19;;;;;/h2-7H,8-9H2,1H3;;4*1H/q+1;+3;;;;/p-4

InChIKey

UIMBHWFFFJEBSC-UHFFFAOYSA-J

Smiles

[BH3+3].[FH-].[FH-].[FH-].[FH-].c1ccc2c(c1)n1SCc3[n+](c1n2)ccc(c3C)OCC(F)(F)F