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Substance Name: 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((1-(3-methoxyphenyl)cyclopropyl)carbonyl)amino)-3-methyl-8-oxo-, (6R-trans)-
RN: 108098-17-5
InChIKey: LAMDJNAGEASRGO-CZUORRHYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H20-N2-O5-S

Molecular Weight

  • 388.442
 
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Names and Synonyms

Synonym

  • BRN 5656359

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 108098-17-5

System Generated Number

  • 0108098175

Structure Descriptors

InChI

1S/C19H20N2O5S/c1-10-9-27-16-13(15(22)21(16)14(10)17(23)24)20-18(25)19(6-7-19)11-4-3-5-12(8-11)26-2/h3-5,8,13,16H,6-7,9H2,1-2H3,(H,20,25)(H,23,24)/t13-,16-/m1/s1

InChIKey

LAMDJNAGEASRGO-CZUORRHYSA-N

Smiles

CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C3(CC3)c4cccc(c4)OC)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.