2-[(2-fluorophenyl)methylidene]-N-(3-morpholin-4-ium-4-ylpropyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: 2-[(2-fluorophenyl)methylidene]-N-(3-morpholin-4-ium-4-ylpropyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 2-[(2-fluorophenyl)methylene]-N-(3-morpholin-4-ium-4-ylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: 2-[(2-fluorophenyl)methylidene]-N-[3-(4-morpholin-4-iumyl)propyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 2-[(2-fluorophenyl)methylidene]-N-(3-morpholin-4-ium-4-ylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 2-(2-fluorobenzylidene)-3-keto-N-(3-morpholin-4-ium-4-ylpropyl)-4H-1,4-benzothiazine-6-carboxamide Formula: C23H25FN3O3S+ MolecularWeight: 442.526303

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC=CC=C4F)C(=O)N3

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC=CC=C4F)C(=O)N3

InChI

InChI=1S/C23H24FN3O3S/c24-18-5-2-1-4-16(18)15-21-23(29)26-19-14-17(6-7-20(19)31-21)22(28)25-8-3-9-27-10-12-30-13-11-27/h1-2,4-7,14-15H,3,8-13H2,(H,25,28)(H,26,29)/p+1