Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-Butyn-1-amine, 4-((1-(4-(diethylamino)-2-butynyl)-5-nitro-1H-benzimidazol-2-yl)thio)-N,N-diethyl-
RN: 112094-02-7
InChIKey: LIVYTRKJOSUPNY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H31-N5-O2-S

Molecular Weight

  • 441.5969
 
* 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

  • 2-Butyn-1-amine, 4-((1-(4-(diethylamino)-2-butynyl)-5-nitro-1H-benzimidazol-2-yl)thio)-N,N-diethyl-

Registry Numbers

CAS Registry Number

  • 112094-02-7

System Generated Number

  • 0112094027

Structure Descriptors

InChI

1S/C23H31N5O2S/c1-5-25(6-2)15-9-10-17-27-22-14-13-20(28(29)30)19-21(22)24-23(27)31-18-12-11-16-26(7-3)8-4/h13-14,19H,5-8,15-18H2,1-4H3

InChIKey

LIVYTRKJOSUPNY-UHFFFAOYSA-N

Smiles

CCN(CC)CC#CCn1c2ccc(cc2nc1SCC#CCN(CC)CC)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1650mg/kg (1650mg/kg)   Indian Drugs. Vol. 24, Pg. 545, 1987.