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Substance Name: 3H-Pyrazol-3-one, 1,2-dihydro-5-methyl-2-(6-methyl-2-((1-methylethyl)thio)-4-pyrimidinyl)-
RN: 154496-71-6
InChIKey: OBCUVCCTUXHEBM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-N4-O-S

Molecular Weight

  • 264.3514
 
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Names and Synonyms

Synonyms

  • 1,2-Dihydro-5-methyl-2-(6-methyl-2-((1-methylethyl)thio)-4-pyrimidinyl)-3H-pyrazol-3-one
  • 2-Isopropylthio-6-methyl-4-(1-3-methylpyrazolon-5(2H)-yl)pyrimidine

Systematic Name

  • 3H-Pyrazol-3-one, 1,2-dihydro-5-methyl-2-(6-methyl-2-((1-methylethyl)thio)-4-pyrimidinyl)-

Registry Numbers

CAS Registry Number

  • 154496-71-6

System Generated Number

  • 0154496716

Structure Descriptors

InChI

1S/C12H16N4OS/c1-7(2)18-12-13-8(3)5-10(14-12)16-11(17)6-9(4)15-16/h5-7,15H,1-4H3

InChIKey

OBCUVCCTUXHEBM-UHFFFAOYSA-N

Smiles

Cc1cc(=O)n([nH]1)c2cc(nc(n2)SC(C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 1500mg/kg (1500mg/kg)   Pharmaceutical Chemistry Journal Vol. 27, Pg. 551, 1993.