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Substance Name: Acetic acid, ((5-((9-chloro-6H-indolo(2,3-b)quinoxalin-6-yl)methyl)-1-(4-methoxyphenyl)-1H-1,3,4-triazol-2-yl)thio)-
RN: 116989-81-2
InChIKey: BYCLATWCVSVMDI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H19-Cl-N6-O3-S

Molecular Weight

  • 530.9941
 
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Names and Synonyms

  • Acetic acid, ((5-((9-chloro-6H-indolo(2,3-b)quinoxalin-6-yl)methyl)-1-(4-methoxyphenyl)-1H-1,3,4-triazol-2-yl)thio)-

Registry Numbers

CAS Registry Number

  • 116989-81-2

System Generated Number

  • 0116989812

Structure Descriptors

InChI

1S/C26H19ClN6O3S/c1-36-17-9-7-16(8-10-17)33-22(30-31-26(33)37-14-23(34)35)13-32-21-11-6-15(27)12-18(21)24-25(32)29-20-5-3-2-4-19(20)28-24/h2-12H,13-14H2,1H3,(H,34,35)

InChIKey

BYCLATWCVSVMDI-UHFFFAOYSA-N

Smiles

COc1ccc(cc1)n2c(nnc2SCC(=O)O)Cn3c4ccc(cc4c5c3nc6ccccc6n5)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 215mg/kg (215mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
Acta Pharmaceutica Jugoslavica. Vol. 38, Pg. 11, 1988.