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Substance Name: Glycine, N-(4-chloro-6-((2-(dimethylamino)ethyl)amino)-5-(methylthio)-2-pyrimidinyl)-N-methyl-, ethyl ester
RN: 55416-99-4
InChIKey: XPSRAJZJTHSCNL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H24-Cl-N5-O2-S

Molecular Weight

  • 361.8956
 
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Names and Synonyms

Synonym

  • Ethyl N-(4-chloro-6-(2-dimethylaminoethylamino)-5-(methylthio)-2-pyrimidinyl)-N-methylglycine

Systematic Name

  • Glycine, N-(4-chloro-6-((2-(dimethylamino)ethyl)amino)-5-(methylthio)-2-pyrimidinyl)-N-methyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 55416-99-4

System Generated Number

  • 0055416994

Structure Descriptors

InChI

1S/C14H24ClN5O2S/c1-6-22-10(21)9-20(4)14-17-12(15)11(23-5)13(18-14)16-7-8-19(2)3/h6-9H2,1-5H3,(H,16,17,18)

InChIKey

XPSRAJZJTHSCNL-UHFFFAOYSA-N

Smiles

CCOC(=O)CN(C)c1nc(c(c(n1)Cl)SC)NCCN(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 79mg/kg (79mg/kg)   United States Patent Document. Vol. #3968214,
mouse LD50 oral 900mg/kg (900mg/kg)   United States Patent Document. Vol. #3968214,