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

Systemtic Name: 1-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-4-phenyl-1,2,3,4-tetrazole-5-thione Openeye Name: 1-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-4-phenyl-tetrazole-5-thione CAS Name: 1-[[(3R)-3-hydroxy-1-piperidin-1-iumyl]methyl]-4-phenyl-5-tetrazolethione IUPAC Name: 1-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-4-phenyltetrazole-5-thione Traditional Name: 1-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-4-phenyl-tetrazole-5-thione Formula: C13H18N5OS+ MolecularWeight: 292.37992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N5OS/c19-12-7-4-8-16(9-12)10-17-13(20)18(15-14-17)11-5-2-1-3-6-11/h1-3,5-6,12,19H,4,7-10H2/p+1/t12-/m1/s1