5-[4-[9-(2-fluoranyl-4-methylsulfonyl-phenyl)purin-6-yl]oxypiperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[4-[9-(2-fluoranyl-4-methylsulfonyl-phenyl)purin-6-yl]oxypiperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole Openeye Name: 5-[4-[9-(2-fluoro-4-methylsulfonyl-phenyl)purin-6-yl]oxy-1-piperidyl]-3-isopropyl-1,2,4-oxadiazole CAS Name: 5-[4-[[9-(2-fluoro-4-methylsulfonylphenyl)-6-purinyl]oxy]-1-piperidinyl]-3-propan-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[4-[9-(2-fluoro-4-methylsulfonylphenyl)purin-6-yl]oxypiperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole Traditional Name: 5-[4-[9-(2-fluoro-4-mesyl-phenyl)purin-6-yl]oxypiperidino]-3-isopropyl-1,2,4-oxadiazole Formula: C22H24FN7O4S MolecularWeight: 501.533863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)N2CCC(CC2)OC3=NC=NC4=C3N=CN4C5=C(C=C(C=C5)S(=O)(=O)C)F

Isomeric SMILES

CC(C)C1=NOC(=N1)N2CCC(CC2)OC3=NC=NC4=C3N=CN4C5=C(C=C(C=C5)S(=O)(=O)C)F

InChI

InChI=1S/C22H24FN7O4S/c1-13(2)19-27-22(34-28-19)29-8-6-14(7-9-29)33-21-18-20(24-11-25-21)30(12-26-18)17-5-4-15(10-16(17)23)35(3,31)32/h4-5,10-14H,6-9H2,1-3H3