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Substance Name: Bay v 3522
RN: 120635-27-0
InChIKey: GSPMBQQDLRBMID-AGGBKSKLSA-N

Molecular Weight

  • 445.522
 
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Names and Synonyms

Name of Substance

  • Bay v 3522

Synonyms

  • 7-(2-Amino-2-(2-aminobenzothiazol-6-yl-acetoamide))-3-(1-propen-1-yl)-3-cephen-4-carboxylic acid
  • Bay v-3522

Systematic Name

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-((amino(2-amino-6-benzothiazolyl)acetyl)amino)-8-oxo-3-(1-propenyl)-, (6R-(3(Z),6alpha,7beta(R*)))-

Registry Numbers

CAS Registry Number

  • 120635-27-0

System Generated Number

  • 0120635270

Structure Descriptors

InChI

1S/C19H19N5O4S2/c1-2-3-9-7-29-17-13(16(26)24(17)14(9)18(27)28)23-15(25)12(20)8-4-5-10-11(6-8)30-19(21)22-10/h2-6,12-13,17H,7,20H2,1H3,(H2,21,22)(H,23,25)(H,27,28)/b3-2-/t12-,13-,17-/m1/s1

InChIKey

GSPMBQQDLRBMID-AGGBKSKLSA-N

Smiles

c1(cc2c(nc(s2)N)cc1)[C@H](C(N[C@@H]1C(N2C(C(=O)O)=C(\C=C/C)CS[C@H]12)=O)=O)N