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Substance Name: Nicotinamide, N-(alpha-methylphenethyl)thio-
RN: 18010-72-5
InChIKey: MHFWNCHPSFKJJY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-N2-S

Molecular Weight

  • 256.371
 
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Names and Synonyms

Synonyms

  • N-(1-Methyl-2-phenylethyl)-3-pyridinecarboxamide
  • N-(alpha-Methylphenethyl)thionicotinamide
  • Thiophenatine

Systematic Names

  • 3-Pyridinecarbothioamide, N-(1-methyl-2-phenylethyl)- (9CI)
  • Nicotinamide, N-(alpha-methylphenethyl)thio-

Registry Numbers

CAS Registry Number

  • 18010-72-5

System Generated Number

  • 0018010725

Structure Descriptors

InChI

1S/C15H16N2S/c1-12(10-13-6-3-2-4-7-13)17-15(18)14-8-5-9-16-11-14/h2-9,11-12H,10H2,1H3,(H,17,18)

InChIKey

MHFWNCHPSFKJJY-UHFFFAOYSA-N

Smiles

c1c(cccn1)C(N[C@@H](Cc1ccccc1)C)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 2100mg/kg (2100mg/kg)   Pharmacology and Toxicology. English translation of FATOAO. Vol. 21, Pg. 126, 1958.
mouse LD50 subcutaneous 1200mg/kg (1200mg/kg)   Farmakologiya i Toksikologiya Vol. 19(1), Pg. 16, 1956.