2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(4-methoxy-3-sulfamoyl-phenyl)ethanamide

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]-N-(4-methoxy-3-sulfamoyl-phenyl)ethanamide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)acetamide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)-N-(4-methoxy-3-sulfamoylphenyl)acetamide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)-N-(4-methoxy-3-sulfamoylphenyl)acetamide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)acetamide Formula: C16H18N6O6S MolecularWeight: 422.41572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NC3=CC(=C(C=C3)OC)S(=O)(=O)N

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CC(=O)NC3=CC(=C(C=C3)OC)S(=O)(=O)N

InChI

InChI=1S/C16H18N6O6S/c1-20-8-18-14-13(20)15(24)22(16(25)21(14)2)7-12(23)19-9-4-5-10(28-3)11(6-9)29(17,26)27/h4-6,8H,7H2,1-3H3,(H,19,23)(H2,17,26,27)