3-tert-butyl-5-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-3-yl]-1,2,4-oxadiazole

Systemtic Name: 3-tert-butyl-5-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-3-yl]-1,2,4-oxadiazole Openeye Name: 3-tert-butyl-5-[1-(6,7-dimethoxyphthalazin-1-yl)-3-piperidyl]-1,2,4-oxadiazole CAS Name: 3-tert-butyl-5-[1-(6,7-dimethoxy-1-phthalazinyl)-3-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-tert-butyl-5-[1-(6,7-dimethoxyphthalazin-1-yl)piperidin-3-yl]-1,2,4-oxadiazole Traditional Name: 3-tert-butyl-5-[1-(6,7-dimethoxyphthalazin-1-yl)-3-piperidyl]-1,2,4-oxadiazole Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=N1)C2CCCN(C2)C3=NN=CC4=CC(=C(C=C43)OC)OC

Isomeric SMILES

CC(C)(C)C1=NOC(=N1)C2CCCN(C2)C3=NN=CC4=CC(=C(C=C43)OC)OC

InChI

InChI=1S/C21H27N5O3/c1-21(2,3)20-23-19(29-25-20)13-7-6-8-26(12-13)18-15-10-17(28-5)16(27-4)9-14(15)11-22-24-18/h9-11,13H,6-8,12H2,1-5H3