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Substance Name: 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-
RN: 115906-54-2
InChIKey: UWVRFEVFYZRBPD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H24-Cl2-N4-O5-S

Molecular Weight

  • 491.3936
 
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Names and Synonyms

Synonym

  • BRN 5674722

Systematic Name

  • 1H-Imidazole, 5-((2,3-dichloropropyl)thio)-2-methyl-4-nitro-1-((3-nitro-4- (pentyloxy)phenyl)methyl)-

Registry Numbers

CAS Registry Number

  • 115906-54-2

System Generated Number

  • 0115906542

Structure Descriptors

InChI

1S/C19H24Cl2N4O5S/c1-3-4-5-8-30-17-7-6-14(9-16(17)24(26)27)11-23-13(2)22-18(25(28)29)19(23)31-12-15(21)10-20/h6-7,9,15H,3-5,8,10-12H2,1-2H3

InChIKey

UWVRFEVFYZRBPD-UHFFFAOYSA-N

Smiles

CCCCCOc1ccc(cc1[N+](=O)[O-])Cn2c(nc(c2SCC(CCl)Cl)[N+](=O)[O-])C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal > 2500mg/kg (2500mg/kg)   Pharmaceutical Chemistry Journal Vol. 22, Pg. 287, 1988.