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

Systemtic Name: 5-(4-ethoxyphenyl)-3-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(4-ethoxyphenyl)-3-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(4-ethoxyphenyl)-3-[[(2R)-2-methyl-1-piperidin-1-iumyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(4-ethoxyphenyl)-3-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 3-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]-5-p-phenetyl-1,3,4-oxadiazole-2-thione Formula: C17H24N3O2S+ MolecularWeight: 334.45636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=S)O2)C[NH+]3CCCCC3C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=S)O2)C[NH+]3CCCC[C@H]3C

InChI

InChI=1S/C17H23N3O2S/c1-3-21-15-9-7-14(8-10-15)16-18-20(17(23)22-16)12-19-11-5-4-6-13(19)2/h7-10,13H,3-6,11-12H2,1-2H3/p+1/t13-/m1/s1