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Substance Name: 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-
RN: 112094-08-3
InChIKey: JDPKXMQXONKDEC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H27-N5-O2-S

Molecular Weight

  • 365.4993
 
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Names and Synonyms

Synonym

  • 1,3-Dihydro-1,3-bis((diethylamino)methyl)-4-nitro-2H-benzimidazole-2-thione

Systematic Name

  • 2H-Benzimidazole-2-thione, 1,3-dihydro-1,3-bis((diethylamino)methyl)-4-nitro-

Registry Numbers

CAS Registry Number

  • 112094-08-3

System Generated Number

  • 0112094083

Structure Descriptors

InChI

1S/C17H27N5O2S/c1-5-18(6-2)12-20-14-10-9-11-15(22(23)24)16(14)21(17(20)25)13-19(7-3)8-4/h9-11H,5-8,12-13H2,1-4H3

InChIKey

JDPKXMQXONKDEC-UHFFFAOYSA-N

Smiles

CCN(CC)Cn1c2cccc(c2n(c1=S)CN(CC)CC)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1600mg/kg (1600mg/kg)   Indian Drugs. Vol. 24, Pg. 542, 1987.