2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole

Systemtic Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole Openeye Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-5-(2-thienyl)-1,3,4-oxadiazole CAS Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazine-1,4-diiumyl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole IUPAC Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole Traditional Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]-5-(2-thienyl)-1,3,4-oxadiazole Formula: C19H21N5OS2+2 MolecularWeight: 399.53294

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=NN=C(O2)C3=CC=CS3)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=NN=C(O2)C3=CC=CS3)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C19H19N5OS2/c1-2-5-15-14(4-1)20-18(27-15)13-24-9-7-23(8-10-24)12-17-21-22-19(25-17)16-6-3-11-26-16/h1-6,11H,7-10,12-13H2/p+2