1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-[[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]ethanone IUPAC Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(4-pyridin-1-ium-2-ylpiperazino)-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]thio]ethanone Formula: C18H19N6O2S+ MolecularWeight: 383.44746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CSC3=NN=C(O3)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CSC3=NN=C(O3)C4=CN=CC=C4

InChI

InChI=1S/C18H18N6O2S/c25-16(24-10-8-23(9-11-24)15-5-1-2-7-20-15)13-27-18-22-21-17(26-18)14-4-3-6-19-12-14/h1-7,12H,8-11,13H2/p+1