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Substance Name: Benzamide, N-(2-((((2-methoxyphenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-4-nitro-
RN: 77051-91-3
InChIKey: CSLGFVSTCVWEQO-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-4-nitrobenzamide

Systematic Name

  • Benzamide, N-(2-((((2-methoxyphenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-4-nitro-

Registry Numbers

CAS Registry Number

  • 77051-91-3

System Generated Number

  • 0077051913

Structure Descriptors

InChI

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

InChIKey

CSLGFVSTCVWEQO-UHFFFAOYSA-N

Smiles

N([C@@H]1[C@@H](N(C(c2ccc([N+](=O)[O-])cc2)=O)C)CCC1)C(Nc1c(cccc1)OC)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Pharmacological Research Communications. Vol. 13, Pg. 65, 1981.