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Substance Name: Pentanamide, 4,4-dimethyl-3-oxo-N-(phenylthioxomethyl)-
RN: 178408-10-1
InChIKey: VGHDLKHNJQZHBV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H17-N-O2-S

Molecular Weight

  • 263.3593
 
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Names and Synonyms

Synonym

  • 4,4-Dimethyl-3-oxo-N-(phenylthioxomethyl)pentanamide

Systematic Name

  • Pentanamide, 4,4-dimethyl-3-oxo-N-(phenylthioxomethyl)-

Registry Numbers

CAS Registry Number

  • 178408-10-1

System Generated Number

  • 0178408101

Structure Descriptors

InChI

1S/C14H17NO2S/c1-14(2,3)11(16)9-12(17)15-13(18)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,15,17,18)

InChIKey

VGHDLKHNJQZHBV-UHFFFAOYSA-N

Smiles

CC(C)(C)C(=O)CC(=O)NC(=S)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 181, 1996.