2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-methoxy-3-sulfamoyl-phenyl)ethanamide

Systemtic Name: 2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-methoxy-3-sulfamoyl-phenyl)ethanamide Openeye Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)acetamide CAS Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(4-methoxy-3-sulfamoylphenyl)acetamide IUPAC Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-methoxy-3-sulfamoylphenyl)acetamide Traditional Name: 2-(8-chloro-2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(4-methoxy-3-sulfamoyl-phenyl)acetamide Formula: C16H17ClN6O6S MolecularWeight: 456.86078

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(=O)NC3=CC(=C(C=C3)OC)S(=O)(=O)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(=O)NC3=CC(=C(C=C3)OC)S(=O)(=O)N

InChI

InChI=1S/C16H17ClN6O6S/c1-21-13-12(14(25)22(2)16(21)26)23(15(17)20-13)7-11(24)19-8-4-5-9(29-3)10(6-8)30(18,27)28/h4-6H,7H2,1-3H3,(H,19,24)(H2,18,27,28)