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Substance Name: Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-
RN: 111044-14-5
InChIKey: XXCNXNPSGSKBOD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H19-N3-O4-S

Molecular Weight

  • 421.4751
 
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Names and Synonyms

Synonym

  • N-(2-Benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)thiourea

Systematic Name

  • Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 111044-14-5

System Generated Number

  • 0111044145

Structure Descriptors

InChI

1S/C22H19N3O4S/c1-2-29-18-11-8-16(9-12-18)23-22(30)24-20-13-10-17(25(27)28)14-19(20)21(26)15-6-4-3-5-7-15/h3-14H,2H2,1H3,(H2,23,24,30)

InChIKey

XXCNXNPSGSKBOD-UHFFFAOYSA-N

Smiles

CCOc1ccc(cc1)NC(=S)Nc2ccc(cc2C(=O)c3ccccc3)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Journal of the Indian Chemical Society. Vol. 64, Pg. 46, 1987.