(2S)-2-(2,3-dimethoxyphenyl)-2-morpholin-4-ium-4-yl-ethanethioamide

Systemtic Name: (2S)-2-(2,3-dimethoxyphenyl)-2-morpholin-4-ium-4-yl-ethanethioamide Openeye Name: (2S)-2-(2,3-dimethoxyphenyl)-2-morpholin-4-ium-4-yl-thioacetamide CAS Name: (2S)-2-(2,3-dimethoxyphenyl)-2-(4-morpholin-4-iumyl)ethanethioamide IUPAC Name: (2S)-2-(2,3-dimethoxyphenyl)-2-morpholin-4-ium-4-ylethanethioamide Traditional Name: (2S)-2-(2,3-dimethoxyphenyl)-2-morpholin-4-ium-4-yl-thioacetamide Formula: C14H21N2O3S+ MolecularWeight: 297.39314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(C(=S)N)[NH+]2CCOCC2

Isomeric SMILES

COC1=CC=CC(=C1OC)[C@@H](C(=S)N)[NH+]2CCOCC2

InChI

InChI=1S/C14H20N2O3S/c1-17-11-5-3-4-10(13(11)18-2)12(14(15)20)16-6-8-19-9-7-16/h3-5,12H,6-9H2,1-2H3,(H2,15,20)/p+1/t12-/m0/s1