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

Systemtic Name: 5-[4-[9-[2,5-bis(fluoranyl)-4-methylsulfonyl-phenyl]purin-6-yl]oxypiperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole Openeye Name: 5-[4-[9-(2,5-difluoro-4-methylsulfonyl-phenyl)purin-6-yl]oxy-1-piperidyl]-3-isopropyl-1,2,4-oxadiazole CAS Name: 5-[4-[[9-(2,5-difluoro-4-methylsulfonylphenyl)-6-purinyl]oxy]-1-piperidinyl]-3-propan-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[4-[9-(2,5-difluoro-4-methylsulfonylphenyl)purin-6-yl]oxypiperidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole Traditional Name: 5-[4-[9-(2,5-difluoro-4-mesyl-phenyl)purin-6-yl]oxypiperidino]-3-isopropyl-1,2,4-oxadiazole Formula: C22H23F2N7O4S MolecularWeight: 519.524326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)N2CCC(CC2)OC3=NC=NC4=C3N=CN4C5=CC(=C(C=C5F)S(=O)(=O)C)F

Isomeric SMILES

CC(C)C1=NOC(=N1)N2CCC(CC2)OC3=NC=NC4=C3N=CN4C5=CC(=C(C=C5F)S(=O)(=O)C)F

InChI

InChI=1S/C22H23F2N7O4S/c1-12(2)19-28-22(35-29-19)30-6-4-13(5-7-30)34-21-18-20(25-10-26-21)31(11-27-18)16-8-15(24)17(9-14(16)23)36(3,32)33/h8-13H,4-7H2,1-3H3