3-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole-2-thione Openeye Name: 3-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]methyl]-5-(2-thienyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole-2-thione Traditional Name: 3-[[4-(coumaran-5-ylmethyl)piperazino]methyl]-5-(2-thienyl)-1,3,4-oxadiazole-2-thione Formula: C20H22N4O2S2 MolecularWeight: 414.54428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)CN4C(=S)OC(=N4)C5=CC=CS5

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)CN4C(=S)OC(=N4)C5=CC=CS5

InChI

InChI=1S/C20H22N4O2S2/c27-20-24(21-19(26-20)18-2-1-11-28-18)14-23-8-6-22(7-9-23)13-15-3-4-17-16(12-15)5-10-25-17/h1-4,11-12H,5-10,13-14H2