4-azanyl-2-methylsulfinyl-5-oxidanidyl-6-phenyl-pyrrolo[3,2-d]pyrimidin-5-ium-7-one

Systemtic Name: 4-azanyl-2-methylsulfinyl-5-oxidanidyl-6-phenyl-pyrrolo[3,2-d]pyrimidin-5-ium-7-one Openeye Name: 4-amino-2-methylsulfinyl-5-oxido-6-phenyl-pyrrolo[3,2-d]pyrimidin-5-ium-7-one CAS Name: 4-amino-2-methylsulfinyl-5-oxido-6-phenyl-7-pyrrolo[3,2-d]pyrimidin-5-iumone IUPAC Name: 4-amino-2-methylsulfinyl-5-oxido-6-phenylpyrrolo[3,2-d]pyrimidin-5-ium-7-one Traditional Name: 4-amino-2-methylsulfinyl-5-oxido-6-phenyl-pyrrolo[3,2-d]pyrimidin-5-ium-7-one Formula: C13H10N4O3S MolecularWeight: 302.3085

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=NC2=C(C(=N1)N)[N+](=C(C2=O)C3=CC=CC=C3)[O-]

Isomeric SMILES

CS(=O)C1=NC2=C(C(=N1)N)[N+](=C(C2=O)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C13H10N4O3S/c1-21(20)13-15-8-10(12(14)16-13)17(19)9(11(8)18)7-5-3-2-4-6-7/h2-6H,1H3,(H2,14,15,16)