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Substance Name: Benzamide, N-(2-((((2-methoxyphenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-2-nitro-
RN: 77051-85-5
InChIKey: KIDCCPZUVSNWLV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H24-N4-O4-S

Molecular Weight

  • 428.511
 
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Names and Synonyms

Synonym

  • N-(2-((((2-Methoxyphenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-2-nitrobenzamide

Systematic Name

  • Benzamide, N-(2-((((2-methoxyphenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-2-nitro-

Registry Numbers

CAS Registry Number

  • 77051-85-5

System Generated Number

  • 0077051855

Structure Descriptors

InChI

1S/C21H24N4O4S/c1-24(20(26)14-8-3-5-11-17(14)25(27)28)18-12-7-10-15(18)22-21(30)23-16-9-4-6-13-19(16)29-2/h3-6,8-9,11,13,15,18H,7,10,12H2,1-2H3,(H2,22,23,30)

InChIKey

KIDCCPZUVSNWLV-UHFFFAOYSA-N

Smiles

C1[C@@H]([C@@H](N(C(c2c(cccc2)[N+](=O)[O-])=O)C)CC1)NC(Nc1c(cccc1)OC)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Pharmacological Research Communications. Vol. 13, Pg. 65, 1981.