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Substance Name: Thiourea, N-((2-chloro-13-phenyl-5H-dibenzo(d,h)(1,3,6)triazonin-6-yl)methyl)-N'-(4-ethoxyphenyl)-
RN: 103687-03-2
InChIKey: AOOZEBPBQOQCIC-JTHRFTPNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H26-Cl-N5-O-S

Molecular Weight

  • 540.0884
 
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Names and Synonyms

Synonym

  • 8-Chloro-6-phenyl-12-((4-ethoxyphenyl)thiourea)-11H-dibenzo(b,g)(1,3,6)triazonine

Systematic Name

  • Thiourea, N-((2-chloro-13-phenyl-5H-dibenzo(d,h)(1,3,6)triazonin-6-yl)methyl)-N'-(4-ethoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 103687-03-2

System Generated Number

  • 0103687032

Structure Descriptors

InChI

1S/C30H26ClN5OS/c1-2-37-23-15-13-22(14-16-23)33-30(38)32-19-28-34-25-17-12-21(31)18-24(25)29(20-8-4-3-5-9-20)36-27-11-7-6-10-26(27)35-28/h3-18H,2,19H2,1H3,(H,34,35)(H2,32,33,38)/b36-29-

InChIKey

AOOZEBPBQOQCIC-JTHRFTPNSA-N

Smiles

CCOc1ccc(cc1)NC(=S)NCc2/[nH]c3ccc(cc3/c(n\c4ccccc4\n2)/c5ccccc5)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 681mg/kg (681mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 47, Pg. 181, 1985.