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Substance Name: Morpholine, 4-((4-(2-chlorophenyl)-9-methyl-6H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepin-2-yl)carbonyl)-
RN: 105219-60-1
InChIKey: AZHYLABGKBWMMK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H18-Cl-N5-O2-S

Molecular Weight

  • 427.9142
 
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Names and Synonyms

  • Morpholine, 4-((4-(2-chlorophenyl)-9-methyl-6H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepin-2-yl)carbonyl)-

Registry Numbers

CAS Registry Number

  • 105219-60-1

System Generated Number

  • 0105219601

Structure Descriptors

InChI

1S/C20H18ClN5O2S/c1-12-23-24-17-11-22-18(13-4-2-3-5-15(13)21)14-10-16(29-20(14)26(12)17)19(27)25-6-8-28-9-7-25/h2-5,10H,6-9,11H2,1H3

InChIKey

AZHYLABGKBWMMK-UHFFFAOYSA-N

Smiles

Cc1nnc2n1-c3c(cc(s3)C(=O)N4CCOCC4)C(=NC2)c5ccccc5Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 400mg/kg (400mg/kg)   United States Patent Document. Vol. #4968794,
mouse LD50 oral 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #5082839,