(2S)-2-(3-ethoxyphenyl)-2-morpholin-4-ium-4-yl-ethanethioamide

Systemtic Name: (2S)-2-(3-ethoxyphenyl)-2-morpholin-4-ium-4-yl-ethanethioamide Openeye Name: (2S)-2-(3-ethoxyphenyl)-2-morpholin-4-ium-4-yl-thioacetamide CAS Name: (2S)-2-(3-ethoxyphenyl)-2-(4-morpholin-4-iumyl)ethanethioamide IUPAC Name: (2S)-2-(3-ethoxyphenyl)-2-morpholin-4-ium-4-ylethanethioamide Traditional Name: (2S)-2-morpholin-4-ium-4-yl-2-m-phenetyl-thioacetamide Formula: C14H21N2O2S+ MolecularWeight: 281.39374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(C(=S)N)[NH+]2CCOCC2

Isomeric SMILES

CCOC1=CC=CC(=C1)[C@@H](C(=S)N)[NH+]2CCOCC2

InChI

InChI=1S/C14H20N2O2S/c1-2-18-12-5-3-4-11(10-12)13(14(15)19)16-6-8-17-9-7-16/h3-5,10,13H,2,6-9H2,1H3,(H2,15,19)/p+1/t13-/m0/s1