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Substance Name: Acetamide, 2-((5-acetyl-3-cyano-1,4,5,6-tetrahydro-6-hydroxy-6-methyl-4-(3-nitrophenyl)-2-pyridinyl)thio)-
RN: 117491-08-4
InChIKey: YJJOIGLTGXHVNG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-N4-O5-S

Molecular Weight

  • 390.4182
 
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Names and Synonyms

Synonym

  • BRN 5646129

Systematic Name

  • Acetamide, 2-((5-acetyl-3-cyano-1,4,5,6-tetrahydro-6-hydroxy-6-methyl-4-(3-nitrophenyl)-2-pyridinyl)thio)-

Registry Numbers

CAS Registry Number

  • 117491-08-4

System Generated Number

  • 0117491084

Structure Descriptors

InChI

1S/C17H18N4O5S/c1-9(22)15-14(10-4-3-5-11(6-10)21(25)26)12(7-18)16(20-17(15,2)24)27-8-13(19)23/h3-6,14-15,20,24H,8H2,1-2H3,(H2,19,23)

InChIKey

YJJOIGLTGXHVNG-UHFFFAOYSA-N

Smiles

CC(=O)C1C(C(=C(NC1(C)O)SCC(=O)N)C#N)c2cccc(c2)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Russian Pharmacology and Toxicology Vol. 51, Pg. 191, 1988.