5-(4-ethoxyphenyl)-3-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(4-ethoxyphenyl)-3-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(4-ethoxyphenyl)-3-[[4-(2-pyridylmethyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(4-ethoxyphenyl)-3-[[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(4-ethoxyphenyl)-3-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-p-phenetyl-3-[[4-(2-pyridylmethyl)piperazino]methyl]-1,3,4-oxadiazole-2-thione Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C21H25N5O2S/c1-2-27-19-8-6-17(7-9-19)20-23-26(21(29)28-20)16-25-13-11-24(12-14-25)15-18-5-3-4-10-22-18/h3-10H,2,11-16H2,1H3