2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(4-morpholinosulfonylphenyl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(4-morpholinosulfonylphenyl)acetamide Formula: C19H22N6O6S MolecularWeight: 462.47958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C19H22N6O6S/c1-22-17-16(18(27)23(2)19(22)28)24(12-20-17)11-15(26)21-13-3-5-14(6-4-13)32(29,30)25-7-9-31-10-8-25/h3-6,12H,7-11H2,1-2H3,(H,21,26)