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

Systemtic Name: 5-(3-bromophenyl)-3-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(3-bromophenyl)-3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(3-bromophenyl)-3-[[(3R)-3-hydroxy-1-piperidin-1-iumyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(3-bromophenyl)-3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-(3-bromophenyl)-3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Formula: C14H17BrN3O2S+ MolecularWeight: 371.27268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CN2C(=S)OC(=N2)C3=CC(=CC=C3)Br)O

Isomeric SMILES

C1C[C@H](C[NH+](C1)CN2C(=S)OC(=N2)C3=CC(=CC=C3)Br)O

InChI

InChI=1S/C14H16BrN3O2S/c15-11-4-1-3-10(7-11)13-16-18(14(21)20-13)9-17-6-2-5-12(19)8-17/h1,3-4,7,12,19H,2,5-6,8-9H2/p+1/t12-/m1/s1