1,9-Dihydro-2-[[(4-nitrophenyl)methyl]thio]-6H-purin-6-one
CAS Registry Number®
15870-56-1
CAS Name
1,9-Dihydro-2-[[(4-nitrophenyl)methyl]thio]-6H-purin-6-oneMolecular Formula
C12H9N5O3SMolecular Mass
303.30Cite this Page
1,9-Dihydro-2-[[(4-nitrophenyl)methyl]thio]-6H-purin-6-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=15870-56-1 (retrieved ) (CAS RN: 15870-56-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C12H9N5O3S/c18-11-9-10(14-6-13-9)15-12(16-11)21-5-7-1-3-8(4-2-7)17(19)20/h1-4,6H,5H2,(H2,13,14,15,16,18)
InChIKey
InChIKey=WHKVCAGKGQNACH-UHFFFAOYSA-N
SMILES
O=C1C2=C(NC(SCC3=CC=C(N(=O)=O)C=C3)=N1)N=CN2
Canonical SMILES
O=C1N=C(SCC2=CC=C(C=C2)N(=O)=O)NC=3N=CNC13
Other Names for this Substance
- 6H-Purin-6-one, 1,9-dihydro-2-[[(4-nitrophenyl)methyl]thio]-
- Hypoxanthine, 2-[(p-nitrobenzyl)thio]-
- 1,9-Dihydro-2-[[(4-nitrophenyl)methyl]thio]-6H-purin-6-one
- 2-[(4-Nitrophenyl)methylsulfanyl]-3,7-dihydropurin-6-one
- 2-(4-Nitro-benzylsulfanyl)-9H-purin-6-ol