5-[2,6-bis(oxidanylidene)-3,7-dihydropurin-8-yl]-2,4-dimethoxy-benzenesulfonamide

Systemtic Name: 5-[2,6-bis(oxidanylidene)-3,7-dihydropurin-8-yl]-2,4-dimethoxy-benzenesulfonamide Openeye Name: 5-(2,6-dioxo-3,7-dihydropurin-8-yl)-2,4-dimethoxy-benzenesulfonamide CAS Name: 5-(2,6-dioxo-3,7-dihydropurin-8-yl)-2,4-dimethoxybenzenesulfonamide IUPAC Name: 5-(2,6-dioxo-3,7-dihydropurin-8-yl)-2,4-dimethoxybenzenesulfonamide Traditional Name: 5-(2,6-diketo-3,7-dihydropurin-8-yl)-2,4-dimethoxy-benzenesulfonamide Formula: C13H13N5O6S MolecularWeight: 367.33722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=NC3=C(N2)C(=O)NC(=O)N3)S(=O)(=O)N)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=NC3=C(N2)C(=O)NC(=O)N3)S(=O)(=O)N)OC

InChI

InChI=1S/C13H13N5O6S/c1-23-6-4-7(24-2)8(25(14,21)22)3-5(6)10-15-9-11(16-10)17-13(20)18-12(9)19/h3-4H,1-2H3,(H2,14,21,22)(H3,15,16,17,18,19,20)