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Substance Name: 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-methyl-8-oxo- 7-(((1-phenylcyclopropyl)carbonyl)amino)-, (6R-trans)-
RN: 108098-16-4
InChIKey: VQGJBDWJEGGATG-IUODEOHRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H18-N2-O4-S

Molecular Weight

  • 358.4162
 
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Names and Synonyms

Synonym

  • BRN 5645070

Systematic Name

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-methyl-8-oxo- 7-(((1-phenylcyclopropyl)carbonyl)amino)-, (6R-trans)-

Registry Numbers

CAS Registry Number

  • 108098-16-4

System Generated Number

  • 0108098164

Structure Descriptors

InChI

1S/C18H18N2O4S/c1-10-9-25-15-12(14(21)20(15)13(10)16(22)23)19-17(24)18(7-8-18)11-5-3-2-4-6-11/h2-6,12,15H,7-9H2,1H3,(H,19,24)(H,22,23)/t12-,15-/m1/s1

InChIKey

VQGJBDWJEGGATG-IUODEOHRSA-N

Smiles

CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C3(CC3)c4ccccc4)SC1)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 2gm/kg (2000mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 115, 1987.