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Substance Name: Benzamide, N-(2-((((4-chlorophenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-4-nitro-
RN: 77051-92-4
InChIKey: PLFRWHXFYXXILR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-Cl-N4-O3-S

Molecular Weight

  • 432.9299
 
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Names and Synonyms

Synonym

  • N-(2-((((4-Chlorophenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-4-nitrobenzamide

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 77051-92-4

System Generated Number

  • 0077051924

Structure Descriptors

InChI

1S/C20H21ClN4O3S/c1-24(19(26)13-5-11-16(12-6-13)25(27)28)18-4-2-3-17(18)23-20(29)22-15-9-7-14(21)8-10-15/h5-12,17-18H,2-4H2,1H3,(H2,22,23,29)

InChIKey

PLFRWHXFYXXILR-UHFFFAOYSA-N

Smiles

CN(C1CCCC1NC(=S)Nc2ccc(cc2)Cl)C(=O)c3ccc(cc3)[N+](=O)[O-]

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.