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Substance Name: 6H-(1,3)Thiazino(2,3-f)purine-3(2H)-acetic acid, 1,4,7,8-tetrahydro-2,4-dioxo-1-methyl-, butyl ester
RN: 178452-78-3
InChIKey: MYAVMWGHVBUPLW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H20-N4-O4-S

Molecular Weight

  • 352.413
 
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Names and Synonyms

  • 6H-(1,3)Thiazino(2,3-f)purine-3(2H)-acetic acid, 1,4,7,8-tetrahydro-2,4-dioxo-1-methyl-, butyl ester

Registry Numbers

CAS Registry Number

  • 178452-78-3

System Generated Number

  • 0178452783

Structure Descriptors

InChI

1S/C15H20N4O4S/c1-3-4-7-23-10(20)9-19-13(21)11-12(17(2)15(19)22)16-14-18(11)6-5-8-24-14/h3-9H2,1-2H3

InChIKey

MYAVMWGHVBUPLW-UHFFFAOYSA-N

Smiles

CCCCOC(=O)Cn1c(=O)c2c(nc3n2CCCS3)n(c1=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 390mg/kg (390mg/kg)   Pharmaceutical Chemistry Journal Vol. 30, Pg. 194, 1996.