3-[oxan-2-yloxy(pyridin-2-yl)methyl]-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2,4-thiadiazole

Systemtic Name: 3-[oxan-2-yloxy(pyridin-2-yl)methyl]-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2,4-thiadiazole Openeye Name: 5-[4-(2-pyridyl)piperazin-1-yl]-3-[2-pyridyl(tetrahydropyran-2-yloxy)methyl]-1,2,4-thiadiazole CAS Name: 3-[2-oxanyloxy(2-pyridinyl)methyl]-5-[4-(2-pyridinyl)-1-piperazinyl]-1,2,4-thiadiazole IUPAC Name: 3-[oxan-2-yloxy(pyridin-2-yl)methyl]-5-(4-pyridin-2-ylpiperazin-1-yl)-1,2,4-thiadiazole Traditional Name: 5-[4-(2-pyridyl)piperazino]-3-[2-pyridyl(tetrahydropyran-2-yloxy)methyl]-1,2,4-thiadiazole Formula: C22H26N6O2S MolecularWeight: 438.54584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC(C2=CC=CC=N2)C3=NSC(=N3)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

C1CCOC(C1)OC(C2=CC=CC=N2)C3=NSC(=N3)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C22H26N6O2S/c1-4-10-23-17(7-1)20(30-19-9-3-6-16-29-19)21-25-22(31-26-21)28-14-12-27(13-15-28)18-8-2-5-11-24-18/h1-2,4-5,7-8,10-11,19-20H,3,6,9,12-16H2