3-fluoranyl-4-[6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]oxypurin-9-yl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-[6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]oxypurin-9-yl]benzenesulfonamide Openeye Name: 3-fluoro-4-[6-[4-(3-isopropyl-1,2,4-oxadiazol-5-yl)cyclohexoxy]purin-9-yl]benzenesulfonamide CAS Name: 3-fluoro-4-[6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]oxy-9-purinyl]benzenesulfonamide IUPAC Name: 3-fluoro-4-[6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]oxypurin-9-yl]benzenesulfonamide Traditional Name: 3-fluoro-4-[6-[4-(3-isopropyl-1,2,4-oxadiazol-5-yl)cyclohexoxy]purin-9-yl]benzenesulfonamide Formula: C22H24FN7O4S MolecularWeight: 501.533863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)C2CCC(CC2)OC3=NC=NC4=C3N=CN4C5=C(C=C(C=C5)S(=O)(=O)N)F

Isomeric SMILES

CC(C)C1=NOC(=N1)C2CCC(CC2)OC3=NC=NC4=C3N=CN4C5=C(C=C(C=C5)S(=O)(=O)N)F

InChI

InChI=1S/C22H24FN7O4S/c1-12(2)19-28-21(34-29-19)13-3-5-14(6-4-13)33-22-18-20(25-10-26-22)30(11-27-18)17-8-7-15(9-16(17)23)35(24,31)32/h7-14H,3-6H2,1-2H3,(H2,24,31,32)