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

Systemtic Name: 5-(4-methylphenyl)-3-[(4-oxidanylpiperidin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 3-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-5-(p-tolyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-[(4-hydroxy-1-piperidin-1-iumyl)methyl]-5-(4-methylphenyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-5-(4-methylphenyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-[(4-hydroxypiperidin-1-ium-1-yl)methyl]-5-(p-tolyl)-1,3,4-oxadiazole-2-thione Formula: C15H20N3O2S+ MolecularWeight: 306.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=S)O2)C[NH+]3CCC(CC3)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=S)O2)C[NH+]3CCC(CC3)O

InChI

InChI=1S/C15H19N3O2S/c1-11-2-4-12(5-3-11)14-16-18(15(21)20-14)10-17-8-6-13(19)7-9-17/h2-5,13,19H,6-10H2,1H3/p+1