5-(4-methoxyphenyl)-3-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(4-methoxyphenyl)-3-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-5-(4-methoxyphenyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-[[(3R)-3-hydroxy-1-piperidin-1-iumyl]methyl]-5-(4-methoxyphenyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-5-(4-methoxyphenyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-5-(4-methoxyphenyl)-1,3,4-oxadiazole-2-thione Formula: C15H20N3O3S+ MolecularWeight: 322.4026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=S)O2)C[NH+]3CCCC(C3)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=S)O2)C[NH+]3CCC[C@H](C3)O

InChI

InChI=1S/C15H19N3O3S/c1-20-13-6-4-11(5-7-13)14-16-18(15(22)21-14)10-17-8-2-3-12(19)9-17/h4-7,12,19H,2-3,8-10H2,1H3/p+1/t12-/m1/s1