3-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-5-[(2-propylquinazolin-4-yl)oxymethyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-5-[(2-propylquinazolin-4-yl)oxymethyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-[(2-propylquinazolin-4-yl)oxymethyl]-3-[[4-(p-tolyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 3-[[4-(4-methylphenyl)-1-piperazinyl]methyl]-5-[(2-propyl-4-quinazolinyl)oxymethyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-5-[(2-propylquinazolin-4-yl)oxymethyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-[(2-propylquinazolin-4-yl)oxymethyl]-3-[[4-(p-tolyl)piperazino]methyl]-1,3,4-oxadiazole-2-thione Formula: C26H30N6O2S MolecularWeight: 490.6204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=N1)OCC3=NN(C(=S)O3)CN4CCN(CC4)C5=CC=C(C=C5)C

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=N1)OCC3=NN(C(=S)O3)CN4CCN(CC4)C5=CC=C(C=C5)C

InChI

InChI=1S/C26H30N6O2S/c1-3-6-23-27-22-8-5-4-7-21(22)25(28-23)33-17-24-29-32(26(35)34-24)18-30-13-15-31(16-14-30)20-11-9-19(2)10-12-20/h4-5,7-12H,3,6,13-18H2,1-2H3