4-[2-ethyl-4,7-dimethyl-1,3-bis(oxidanylidene)purino[7,8-a]imidazol-6-yl]benzenesulfonamide

Systemtic Name: 4-[2-ethyl-4,7-dimethyl-1,3-bis(oxidanylidene)purino[7,8-a]imidazol-6-yl]benzenesulfonamide Openeye Name: 4-(2-ethyl-4,7-dimethyl-1,3-dioxo-purino[7,8-a]imidazol-6-yl)benzenesulfonamide CAS Name: 4-(2-ethyl-4,7-dimethyl-1,3-dioxo-6-purino[7,8-a]imidazolyl)benzenesulfonamide IUPAC Name: 4-(2-ethyl-4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-6-yl)benzenesulfonamide Traditional Name: 4-(2-ethyl-1,3-diketo-4,7-dimethyl-purin[7,8-a]imidazol-6-yl)benzenesulfonamide Formula: C17H18N6O4S MolecularWeight: 402.42762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C3N2C=C(N3C4=CC=C(C=C4)S(=O)(=O)N)C)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C3N2C=C(N3C4=CC=C(C=C4)S(=O)(=O)N)C)N(C1=O)C

InChI

InChI=1S/C17H18N6O4S/c1-4-21-15(24)13-14(20(3)17(21)25)19-16-22(13)9-10(2)23(16)11-5-7-12(8-6-11)28(18,26)27/h5-9H,4H2,1-3H3,(H2,18,26,27)