N-[1,3-bis(cyclopropylmethyl)-7-methyl-2,6-bis(oxidanylidene)purin-8-yl]benzenesulfonamide

Systemtic Name: N-[1,3-bis(cyclopropylmethyl)-7-methyl-2,6-bis(oxidanylidene)purin-8-yl]benzenesulfonamide Openeye Name: N-[1,3-bis(cyclopropylmethyl)-7-methyl-2,6-dioxo-purin-8-yl]benzenesulfonamide CAS Name: N-[1,3-bis(cyclopropylmethyl)-7-methyl-2,6-dioxo-8-purinyl]benzenesulfonamide IUPAC Name: N-[1,3-bis(cyclopropylmethyl)-7-methyl-2,6-dioxopurin-8-yl]benzenesulfonamide Traditional Name: N-[1,3-bis(cyclopropylmethyl)-2,6-diketo-7-methyl-purin-8-yl]benzenesulfonamide Formula: C20H23N5O4S MolecularWeight: 429.49272

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NS(=O)(=O)C3=CC=CC=C3)N(C(=O)N(C2=O)CC4CC4)CC5CC5

Isomeric SMILES

CN1C2=C(N=C1NS(=O)(=O)C3=CC=CC=C3)N(C(=O)N(C2=O)CC4CC4)CC5CC5

InChI

InChI=1S/C20H23N5O4S/c1-23-16-17(21-19(23)22-30(28,29)15-5-3-2-4-6-15)24(11-13-7-8-13)20(27)25(18(16)26)12-14-9-10-14/h2-6,13-14H,7-12H2,1H3,(H,21,22)