5-(2,4-dimethoxyphenyl)-3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(2,4-dimethoxyphenyl)-3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(2,4-dimethoxyphenyl)-3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(2,4-dimethoxyphenyl)-3-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(2,4-dimethoxyphenyl)-3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-(2,4-dimethoxyphenyl)-3-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Formula: C18H26N3O3S+ MolecularWeight: 364.48234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CN2C(=S)OC(=N2)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CN2C(=S)OC(=N2)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C18H25N3O3S/c1-4-13-7-5-6-10-20(13)12-21-18(25)24-17(19-21)15-9-8-14(22-2)11-16(15)23-3/h8-9,11,13H,4-7,10,12H2,1-3H3/p+1/t13-/m0/s1