7-methoxy-2-methylsulfanyl-5-oxidanidyl-1H-benzo[g]pteridin-5-ium-4-one

Systemtic Name: 7-methoxy-2-methylsulfanyl-5-oxidanidyl-1H-benzo[g]pteridin-5-ium-4-one Openeye Name: 7-methoxy-2-methylsulfanyl-5-oxido-1H-benzo[g]pteridin-5-ium-4-one CAS Name: 7-methoxy-2-(methylthio)-5-oxido-1H-benzo[g]pteridin-5-ium-4-one IUPAC Name: 7-methoxy-2-methylsulfanyl-5-oxido-1H-benzo[g]pteridin-5-ium-4-one Traditional Name: 7-methoxy-2-(methylthio)-5-oxido-1H-benzo[g]pteridin-5-ium-4-one Formula: C12H10N4O3S MolecularWeight: 290.2978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C3C(=[N+]2[O-])C(=O)N=C(N3)SC

Isomeric SMILES

COC1=CC2=C(C=C1)N=C3C(=[N+]2[O-])C(=O)N=C(N3)SC

InChI

InChI=1S/C12H10N4O3S/c1-19-6-3-4-7-8(5-6)16(18)9-10(13-7)14-12(20-2)15-11(9)17/h3-5H,1-2H3,(H,13,14,15,17)