N-(2-azanyl-4-fluoranyl-phenyl)-3-thiomorpholin-4-ium-4-yl-propanamide

Systemtic Name: N-(2-azanyl-4-fluoranyl-phenyl)-3-thiomorpholin-4-ium-4-yl-propanamide Openeye Name: N-(2-amino-4-fluoro-phenyl)-3-thiomorpholin-4-ium-4-yl-propanamide CAS Name: N-(2-amino-4-fluorophenyl)-3-(4-thiomorpholin-4-iumyl)propanamide IUPAC Name: N-(2-amino-4-fluorophenyl)-3-thiomorpholin-4-ium-4-ylpropanamide Traditional Name: N-(2-amino-4-fluoro-phenyl)-3-thiomorpholin-4-ium-4-yl-propionamide Formula: C13H19FN3OS+ MolecularWeight: 284.372863

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18FN3OS/c14-10-1-2-12(11(15)9-10)16-13(18)3-4-17-5-7-19-8-6-17/h1-2,9H,3-8,15H2,(H,16,18)/p+1