3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-methylsulfonyl-propanamide

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-methylsulfonyl-propanamide Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-methylsulfonyl-propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-methylsulfonylpropanamide IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-methylsulfonylpropanamide Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-mesyl-propionamide Formula: C11H15N5O5S MolecularWeight: 329.3323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)NS(=O)(=O)C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)NS(=O)(=O)C

InChI

InChI=1S/C11H15N5O5S/c1-14-9-8(10(18)15(2)11(14)19)16(6-12-9)5-4-7(17)13-22(3,20)21/h6H,4-5H2,1-3H3,(H,13,17)