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Substance Name: CB-181963
RN: 635292-67-0
UNII: 6784994L0W
InChIKey: VNZAURNTTOSQRE-XQMVPPGESA-N

Molecular Formula

  • C19-H24-F-N11-O5-S2

Molecular Weight

  • 569.6006
 
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Names and Synonyms

Name of Substance

  • CB-181963

Synonyms

  • (-)-CB-181963
  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2Z)-(5-amino-1,2,4-thiadiazol-3-yl)((fluoromethoxy)imino)acetyl)amino)-3-((E)-((imino-1-piperazinylmethyl)methylhydrazono)methyl)-8-oxo-, (6R,7R)-
  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-((fluoromethoxy)imino)acetyl)amino)-3-((E)-(2-(imino-1-piperazinylmethyl)-2-methylhydrazinylidene)methyl)-8-oxo-, (6R,7R)-
  • CAB 175
  • CB-181963
  • UNII-6784994L0W

Registry Numbers

CAS Registry Number

  • 635292-67-0

FDA UNII

  • 6784994L0W

System Generated Number

  • 0635292670

Structure Descriptors

InChI

1S/C19H24FN11O5S2/c1-29(19(22)30-4-2-23-3-5-30)24-6-9-7-37-16-11(15(33)31(16)12(9)17(34)35)25-14(32)10(27-36-8-20)13-26-18(21)38-28-13/h6,11,16,22-23H,2-5,7-8H2,1H3,(H,25,32)(H,34,35)(H2,21,26,28)/b22-19?,24-6+,27-10-/t11-,16-/m1/s1

InChIKey

VNZAURNTTOSQRE-XQMVPPGESA-N

Smiles

CN(\N=C\C1=C(N2[C@H](SC1)[C@H](NC(=O)\C(=N/OCF)\c3nsc(N)n3)C2=O)C(=O)O)C(=N)N4CCNCC4