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Substance Name: 3H-1,4-Benzodiazepin-2(1H)-one, 7-chloro-1-methyl-5-(1-trifluoromethylethoxy)-
RN: 62903-57-5
InChIKey: ZENMZLBNOCJXSX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H12-Cl-F3-N2-O2

Molecular Weight

  • 320.697
 
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Names and Synonyms

Synonyms

  • 5-25-02-00008 (Beilstein Handbook Reference)
  • 7-Chloro-1-methyl-5-(1-trifluoromethylethoxy)-3H-1,4-benzodiazepin-2(1H)-one
  • BRN 0689660

Systematic Name

  • 3H-1,4-Benzodiazepin-2(1H)-one, 7-chloro-1-methyl-5-(1-trifluoromethylethoxy)-

Registry Numbers

CAS Registry Number

  • 62903-57-5

System Generated Number

  • 0062903575

Structure Descriptors

InChI

1S/C13H12ClF3N2O2/c1-7(13(15,16)17)21-12-9-5-8(14)3-4-10(9)19(2)11(20)6-18-12/h3-5,7H,6H2,1-2H3

InChIKey

ZENMZLBNOCJXSX-UHFFFAOYSA-N

Smiles

c12c(N(C(=O)CN=C1O[C@@H](C(F)(F)F)C)C)ccc(c2)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 300mg/kg (300mg/kg) BEHAVIORAL: ANTICONVULSANT Journal of Medicinal Chemistry. Vol. 20, Pg. 952, 1977.