Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-Piperazinecarboxaldehyde, 4-(8-((phenylmethyl)thio)-4-(4-thiomorpholinyl)pyrimido(5,4-d)pyrimidin-2-yl)-, S-oxide
RN: 77777-16-3
InChIKey: GXEORDVOKOIELR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-N7-O2-S2

Molecular Weight

  • 483.6185
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 8-Benzylthio-2-(N-formylpiperazino)-4-(1-oxidothiomorpholino)-pyrimido(5,4-d)pyrimidine

Systematic Name

  • 1-Piperazinecarboxaldehyde, 4-(8-((phenylmethyl)thio)-4-(4-thiomorpholinyl)pyrimido(5,4-d)pyrimidin-2-yl)-, S-oxide

Registry Numbers

CAS Registry Number

  • 77777-16-3

System Generated Number

  • 0077777163

Structure Descriptors

InChI

1S/C22H25N7O2S2/c30-16-27-6-8-29(9-7-27)22-25-19-18(20(26-22)28-10-12-33(31)13-11-28)23-15-24-21(19)32-14-17-4-2-1-3-5-17/h1-5,15-16H,6-14H2

InChIKey

GXEORDVOKOIELR-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CSc2c3c(c(nc(n3)N4CCN(CC4)C=O)N5CCS(=O)CC5)ncn2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 250mg/kg (250mg/kg)   United States Patent Document. Vol. #4690923,