Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: BRN 4219379
RN: 127227-40-1
InChIKey: QVQXHUVJPVDNJS-VXLYETTFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H17-Cl-N6-O2-S2

Molecular Weight

  • 509.0123
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • BRN 4219379

Synonym

  • BRN 4219379

Systematic Name

  • Ethanethioic acid, ((4-chlorophenyl)amino)-, S-(5-(4,5-dihydro-4-(1H-indol-3-ylmethylene)-2-methyl-5-oxo-1H-imidazol-1-yl)-1,3,4-thiadiazol-2-yl) ester

Registry Numbers

CAS Registry Number

  • 127227-40-1

System Generated Number

  • 0127227401

Structure Descriptors

InChI

1S/C23H17ClN6O2S2/c1-13-27-19(10-14-11-26-18-5-3-2-4-17(14)18)21(32)30(13)22-28-29-23(34-22)33-20(31)12-25-16-8-6-15(24)7-9-16/h2-11,25-26H,12H2,1H3/b19-10+

InChIKey

QVQXHUVJPVDNJS-VXLYETTFSA-N

Smiles

CC1=N/C(=C/c2c[nH]c3c2cccc3)/C(=O)N1c4nnc(s4)SC(=O)CNc5ccc(cc5)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1200mg/kg (1200mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 29, Pg. 85, 1990.