N-(3-cyanophenyl)-2-thiomorpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-(3-cyanophenyl)-2-thiomorpholin-4-ium-4-yl-ethanamide Openeye Name: N-(3-cyanophenyl)-2-thiomorpholin-4-ium-4-yl-acetamide CAS Name: N-(3-cyanophenyl)-2-(4-thiomorpholin-4-iumyl)acetamide IUPAC Name: N-(3-cyanophenyl)-2-thiomorpholin-4-ium-4-ylacetamide Traditional Name: N-(3-cyanophenyl)-2-thiomorpholin-4-ium-4-yl-acetamide Formula: C13H16N3OS+ MolecularWeight: 262.35064

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[NH+]1CC(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

C1CSCC[NH+]1CC(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H15N3OS/c14-9-11-2-1-3-12(8-11)15-13(17)10-16-4-6-18-7-5-16/h1-3,8H,4-7,10H2,(H,15,17)/p+1