5-(2-pyridin-2-ylquinolin-4-yl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(2-pyridin-2-ylquinolin-4-yl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-[2-(2-pyridyl)-4-quinolyl]-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-[2-(2-pyridinyl)-4-quinolinyl]-3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(2-pyridin-2-ylquinolin-4-yl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-[2-(2-pyridyl)-4-quinolyl]-3-[[4-(2-pyrimidyl)piperazino]methyl]-1,3,4-oxadiazole-2-thione Formula: C25H22N8OS MolecularWeight: 482.56018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)OC(=N2)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5)C6=NC=CC=N6

Isomeric SMILES

C1CN(CCN1CN2C(=S)OC(=N2)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5)C6=NC=CC=N6

InChI

InChI=1S/C25H22N8OS/c35-25-33(17-31-12-14-32(15-13-31)24-27-10-5-11-28-24)30-23(34-25)19-16-22(21-8-3-4-9-26-21)29-20-7-2-1-6-18(19)20/h1-11,16H,12-15,17H2