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Substance Name: 2H-1,2,4-Oxadiazine-5(6H)-thione, dihydro-2-acetyl-6-methyl-3-(2-methylphenyl)-, cis-(+-)-
RN: 103899-97-4
InChIKey: XYNYXKLWEBVFEL-JOYOIKCWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-N2-O2-S

Molecular Weight

  • 264.3474
 
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Names and Synonyms

Synonyms

  • 2-Acetyl-3-(2-methylphenyl)-6-methyl-tetrahydro-1,2,4-oxadiazine-5-thion
  • cis-(+-)-Dihydro-2-acetyl-6-methyl-3-(2-methylphenyl)-2H-1,2,4-oxadiazine-5(6H)-thione

Systematic Name

  • 2H-1,2,4-Oxadiazine-5(6H)-thione, dihydro-2-acetyl-6-methyl-3-(2-methylphenyl)-, cis-(+-)-

Registry Numbers

CAS Registry Number

  • 103899-97-4

System Generated Number

  • 0103899974

Structure Descriptors

InChI

1S/C13H16N2O2S/c1-8-6-4-5-7-11(8)12-14-13(18)9(2)17-15(12)10(3)16/h4-7,9,12H,1-3H3,(H,14,18)/t9-,12+/m0/s1

InChIKey

XYNYXKLWEBVFEL-JOYOIKCWSA-N

Smiles

Cc1ccccc1[C@@H]2NC(=S)[C@@H](ON2C(=O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4755510,