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Substance Name: 4,7-Pteridinediamine, N,N,N',N'-tetramethyl-6-((phenylmethyl)thio)-2-(1-piperazinyl)-
RN: 96801-80-8
InChIKey: FFICMHCVZYLUGN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H28-N8-S

Molecular Weight

  • 424.5742
 
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Names and Synonyms

Synonyms

  • 6-Benzylthio-4,7-bis(dimethylamino)-2-piperazino-pteridine
  • N,N,N',N'-Tetramethyl-6-((phenylmethyl)thio)-2-(1-piperazinyl)-4,7-pteridinediamine

Systematic Name

  • 4,7-Pteridinediamine, N,N,N',N'-tetramethyl-6-((phenylmethyl)thio)-2-(1-piperazinyl)-

Registry Numbers

CAS Registry Number

  • 96801-80-8

System Generated Number

  • 0096801808

Structure Descriptors

InChI

1S/C21H28N8S/c1-27(2)18-16-17(25-21(26-18)29-12-10-22-11-13-29)24-19(28(3)4)20(23-16)30-14-15-8-6-5-7-9-15/h5-9,22H,10-14H2,1-4H3

InChIKey

FFICMHCVZYLUGN-UHFFFAOYSA-N

Smiles

n1c(nc(c2nc(c(nc12)N(C)C)SCc1ccccc1)N(C)C)N1CCNCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 250mg/kg (250mg/kg)   United States Patent Document. Vol. #4560685,