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Substance Name: Benzoic acid, 4-chloro-2-((1-((3,5-dimethylphenyl)amino)ethylidene)amino)-
RN: 74101-51-2
InChIKey: PEDACOVFHJJABH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H17-Cl-N2-O2

Molecular Weight

  • 316.7863
 
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Names and Synonyms

Synonym

  • N-(2-Carboxy-5-chlorophenyl)-N'-(3',5'-dimethylphenyl)acetamidine

Systematic Name

  • Benzoic acid, 4-chloro-2-((1-((3,5-dimethylphenyl)amino)ethylidene)amino)-

Registry Numbers

CAS Registry Number

  • 74101-51-2

System Generated Number

  • 0074101512

Structure Descriptors

InChI

1S/C17H17ClN2O2/c1-10-6-11(2)8-14(7-10)19-12(3)20-16-9-13(18)4-5-15(16)17(21)22/h4-9H,1-3H3,(H,19,20)(H,21,22)

InChIKey

PEDACOVFHJJABH-UHFFFAOYSA-N

Smiles

Cc1cc(cc(c1)N/C(=N\c2cc(ccc2C(=O)O)Cl)/C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 18, Pg. 443, 1979.