6-methylsulfanyl-4,7-dihydropurin-3-ium 3-oxide

Systemtic Name: 6-methylsulfanyl-4,7-dihydropurin-3-ium 3-oxide Openeye Name: 6-methylsulfanyl-4,7-dihydropurin-3-ium 3-oxide CAS Name: 6-(methylthio)-4,7-dihydropurin-3-ium 3-oxide IUPAC Name: 6-methylsulfanyl-4,7-dihydropurin-3-ium 3-oxide Traditional Name: 6-(methylthio)-4,7-dihydropurin-3-ium 3-oxide Formula: C6H7N4OS+ MolecularWeight: 183.21098

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C2C(N=CN2)[N+](=O)C=N1

Isomeric SMILES

CSC1=C2C(N=CN2)[N+](=O)C=N1

InChI

InChI=1S/C6H7N4OS/c1-12-6-4-5(8-2-7-4)10(11)3-9-6/h2-3,5H,1H3,(H,7,8)/q+1