[4-(2-azanyl-1-methyl-imidazo[4,5-b]pyridin-6-yl)phenyl] hydrogen sulfate

Systemtic Name: [4-(2-azanyl-1-methyl-imidazo[4,5-b]pyridin-6-yl)phenyl] hydrogen sulfate Openeye Name: [4-(2-amino-1-methyl-imidazo[4,5-b]pyridin-6-yl)phenyl] hydrogen sulfate CAS Name: sulfuric acid [4-(2-amino-1-methyl-6-imidazo[4,5-b]pyridinyl)phenyl] ester IUPAC Name: [4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenyl] hydrogen sulfate Traditional Name: sulfuric acid [4-(2-amino-1-methyl-imidazo[4,5-b]pyridin-6-yl)phenyl] ester Formula: C13H12N4O4S MolecularWeight: 320.32378

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=CC(=C2)C3=CC=C(C=C3)OS(=O)(=O)O)N=C1N

Isomeric SMILES

CN1C2=C(N=CC(=C2)C3=CC=C(C=C3)OS(=O)(=O)O)N=C1N

InChI

InChI=1S/C13H12N4O4S/c1-17-11-6-9(7-15-12(11)16-13(17)14)8-2-4-10(5-3-8)21-22(18,19)20/h2-7H,1H3,(H2,14,15,16)(H,18,19,20)