2-(phenylmethylsulfanyl)-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole

Systemtic Name: 2-(phenylmethylsulfanyl)-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Openeye Name: 2-benzylsulfanyl-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole CAS Name: 2-(phenylmethylthio)-5-(4-piperidin-1-iumyl)-1,3,4-oxadiazole IUPAC Name: 2-benzylsulfanyl-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Traditional Name: 2-(benzylthio)-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Formula: C14H18N3OS+ MolecularWeight: 276.37722

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C2=NN=C(O2)SCC3=CC=CC=C3

Isomeric SMILES

C1C[NH2+]CCC1C2=NN=C(O2)SCC3=CC=CC=C3

InChI

InChI=1S/C14H17N3OS/c1-2-4-11(5-3-1)10-19-14-17-16-13(18-14)12-6-8-15-9-7-12/h1-5,12,15H,6-10H2/p+1