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Substance Name: Bms 180680
RN: 142654-34-0
InChIKey: FAUHVXXXXAHABE-ZOUYLLLXSA-N

Molecular Formula

  • C19-H17-N7-O10-S2

Molecular Weight

  • 567.514
 
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Names and Synonyms

Name of Substance

  • Bms 180680

Synonyms

  • 3-((((1-(2-Amino-4-thiazolyl)-2-((2-methyl-4-oxo-1-sulfo-3-azetidinyl)amino)-2-oxoethylidene)amino)oxy)methyl)-6,7-dihydroxy-2-quinoxalinecarboxylic acid (2R-(2alpha,3alpha(Z)))-
  • Bms-180680
  • SQ 84,100

Systematic Name

  • 2-Quinoxalinecarboxylic acid, 3-((((1-(2-amino-4-thiazolyl)-2-((2-methyl-4-oxo-1-sulfo-3-azetidinyl)amino)-2-oxoethylidene)amino)oxy)methyl)-6,7-dihydroxy-, (2R-(2alpha,3alpha(Z)))-

Registry Numbers

CAS Registry Number

  • 142654-34-0

System Generated Number

  • 0142654340

Structure Descriptors

InChI

1S/C19H17N7O10S2/c1-6-13(17(30)26(6)38(33,34)35)24-16(29)14(10-5-37-19(20)23-10)25-36-4-9-15(18(31)32)22-8-3-12(28)11(27)2-7(8)21-9/h2-3,5-6,13,27-28H,4H2,1H3,(H2,20,23)(H,24,29)(H,31,32)(H,33,34,35)/b25-14-/t6-,13+/m0/s1

InChIKey

FAUHVXXXXAHABE-ZOUYLLLXSA-N

Smiles

n1c(c(nc2cc(c(cc12)O)O)CO\N=C(/C(=O)N[C@@H]1[C@@H](N(C1=O)S(=O)(=O)O)C)c1nc(sc1)N)C(=O)O