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Substance Name: 1,3-Benzenediamine, N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-4,6-dinitro-N'-(3-(4-morpholinyl)propyl)-
RN: 142744-22-7
InChIKey: YCFVMRRJBBQZHF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H34-N6-O6-S

Molecular Weight

  • 522.6236
 
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Names and Synonyms

Synonym

  • BRN 5841077

Systematic Name

  • 1,3-Benzenediamine, N-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-4,6-dinitro-N'-(3-(4-morpholinyl)propyl)-

Registry Numbers

CAS Registry Number

  • 142744-22-7

System Generated Number

  • 0142744227

Structure Descriptors

InChI

1S/C23H34N6O6S/c1-26(2)16-18-4-5-19(35-18)17-36-13-7-25-21-14-20(22(28(30)31)15-23(21)29(32)33)24-6-3-8-27-9-11-34-12-10-27/h4-5,14-15,24-25H,3,6-13,16-17H2,1-2H3

InChIKey

YCFVMRRJBBQZHF-UHFFFAOYSA-N

Smiles

CN(C)Cc1ccc(o1)CSCCNc2cc(c(cc2[N+](=O)[O-])[N+](=O)[O-])NCCCN3CCOCC3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 35, Pg. 3141, 1991.