4-[2,6-bis(oxidanylidene)-1-propyl-3,7-dihydropurin-8-yl]-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[2,6-bis(oxidanylidene)-1-propyl-3,7-dihydropurin-8-yl]-N-phenyl-benzenesulfonamide Openeye Name: 4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)-N-phenyl-benzenesulfonamide CAS Name: 4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)-N-phenylbenzenesulfonamide IUPAC Name: 4-(2,6-dioxo-1-propyl-3,7-dihydropurin-8-yl)-N-phenylbenzenesulfonamide Traditional Name: 4-(2,6-diketo-1-propyl-3,7-dihydropurin-8-yl)-N-phenyl-benzenesulfonamide Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(NC1=O)N=C(N2)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(NC1=O)N=C(N2)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H19N5O4S/c1-2-12-25-19(26)16-18(23-20(25)27)22-17(21-16)13-8-10-15(11-9-13)30(28,29)24-14-6-4-3-5-7-14/h3-11,24H,2,12H2,1H3,(H,21,22)(H,23,27)