2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(pyridin-2-ylmethyl)ethanesulfonamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(pyridin-2-ylmethyl)ethanesulfonamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-pyridylmethyl)ethanesulfonamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(2-pyridinylmethyl)ethanesulfonamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(pyridin-2-ylmethyl)ethanesulfonamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-pyridylmethyl)ethanesulfonamide Formula: C15H18N6O4S MolecularWeight: 378.40622

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCS(=O)(=O)NCC3=CC=CC=N3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCS(=O)(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C15H18N6O4S/c1-19-13-12(14(22)20(2)15(19)23)21(10-17-13)7-8-26(24,25)18-9-11-5-3-4-6-16-11/h3-6,10,18H,7-9H2,1-2H3