6-Thioxanthine
CAS Registry Number®
2002-59-7
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CAS Name
6-ThioxanthineMolecular Formula
C5H4N4OSMolecular Mass
168.18Cite this Page
6-Thioxanthine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2002-59-7 (retrieved ) (CAS RN: 2002-59-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C5H4N4OS/c10-5-8-3-2(4(11)9-5)6-1-7-3/h1H,(H3,6,7,8,9,10,11)
InChIKey
InChIKey=RJOXFJDOUQJOMQ-UHFFFAOYSA-N
SMILES
S=C1C2=C(NC(=O)N1)N=CN2
Canonical SMILES
O=C1NC(=S)C=2NC=NC2N1
Other Names for this Substance
- 2H-Purin-2-one, 1,3,6,9-tetrahydro-6-thioxo-
- Xanthine, 6-thio-
- 2H-Purin-2-one, 1,3,6,7-tetrahydro-6-thioxo-
- 1,3,6,9-Tetrahydro-6-thioxo-2H-purin-2-one
- 6-Thioxanthine
Deleted or Replaced CAS Registry Numbers
3782-88-5
