N-[4-azanyl-3-(trifluoromethyl)phenyl]-2-thiomorpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[4-azanyl-3-(trifluoromethyl)phenyl]-2-thiomorpholin-4-ium-4-yl-ethanamide Openeye Name: N-[4-amino-3-(trifluoromethyl)phenyl]-2-thiomorpholin-4-ium-4-yl-acetamide CAS Name: N-[4-amino-3-(trifluoromethyl)phenyl]-2-(4-thiomorpholin-4-iumyl)acetamide IUPAC Name: N-[4-amino-3-(trifluoromethyl)phenyl]-2-thiomorpholin-4-ium-4-ylacetamide Traditional Name: N-[4-amino-3-(trifluoromethyl)phenyl]-2-thiomorpholin-4-ium-4-yl-acetamide Formula: C13H17F3N3OS+ MolecularWeight: 320.35379

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16F3N3OS/c14-13(15,16)10-7-9(1-2-11(10)17)18-12(20)8-19-3-5-21-6-4-19/h1-2,7H,3-6,8,17H2,(H,18,20)/p+1