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Substance Name: 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(((tetrahydro-5-((4-methylphenyl)methyl)-2-furanyl)carbonyl)amino)-, (2S-(2-alpha,5-alpha,6-beta))-
RN: 62042-70-0
InChIKey: KZWVVJFBNUXDPR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N2-O5-S

Molecular Weight

  • 418.5114
 
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Names and Synonyms

Synonym

  • BRN 5394588

Systematic Name

  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(((tetrahydro-5-((4-methylphenyl)methyl)-2-furanyl)carbonyl)amino)-, (2S-(2-alpha,5-alpha,6-beta))-

Registry Numbers

CAS Registry Number

  • 62042-70-0

System Generated Number

  • 0062042700

Structure Descriptors

InChI

1S/C21H26N2O5S/c1-11-4-6-12(7-5-11)10-13-8-9-14(28-13)17(24)22-15-18(25)23-16(20(26)27)21(2,3)29-19(15)23/h4-7,13-16,19H,8-10H2,1-3H3,(H,22,24)(H,26,27)

InChIKey

KZWVVJFBNUXDPR-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)CC2CCC(O2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 150mg/kg (150mg/kg)   Pharmaceutical Chemistry Journal Vol. 10, Pg. 1028, 1976.