[2-methylsulfanyl-5,7-bis(oxidanylidene)-1-phenyl-4H-imidazo[4,5-b]pyridin-6-yl] benzenesulfonate

Systemtic Name: [2-methylsulfanyl-5,7-bis(oxidanylidene)-1-phenyl-4H-imidazo[4,5-b]pyridin-6-yl] benzenesulfonate Openeye Name: (2-methylsulfanyl-5,7-dioxo-1-phenyl-4H-imidazo[4,5-b]pyridin-6-yl) benzenesulfonate CAS Name: benzenesulfonic acid [2-(methylthio)-5,7-dioxo-1-phenyl-4H-imidazo[4,5-b]pyridin-6-yl] ester IUPAC Name: (2-methylsulfanyl-5,7-dioxo-1-phenyl-4H-imidazo[4,5-b]pyridin-6-yl) benzenesulfonate Traditional Name: benzenesulfonic acid [5,7-diketo-2-(methylthio)-1-phenyl-4H-imidazo[4,5-b]pyridin-6-yl] ester Formula: C19H15N3O5S2 MolecularWeight: 429.4695

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(N1C3=CC=CC=C3)C(=O)C(C(=O)N2)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CSC1=NC2=C(N1C3=CC=CC=C3)C(=O)C(C(=O)N2)OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H15N3O5S2/c1-28-19-21-17-14(22(19)12-8-4-2-5-9-12)15(23)16(18(24)20-17)27-29(25,26)13-10-6-3-7-11-13/h2-11,16H,1H3,(H,20,24)