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

Systemtic Name: 2-[(3-chlorophenyl)methylidene]-N-(3-morpholin-4-ium-4-ylpropyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 2-[(3-chlorophenyl)methylene]-N-(3-morpholin-4-ium-4-ylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: 2-[(3-chlorophenyl)methylidene]-N-[3-(4-morpholin-4-iumyl)propyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 2-[(3-chlorophenyl)methylidene]-N-(3-morpholin-4-ium-4-ylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 2-(3-chlorobenzylidene)-3-keto-N-(3-morpholin-4-ium-4-ylpropyl)-4H-1,4-benzothiazine-6-carboxamide Formula: C23H25ClN3O3S+ MolecularWeight: 458.9809

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC(=CC=C4)Cl)C(=O)N3

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC(=CC=C4)Cl)C(=O)N3

InChI

InChI=1S/C23H24ClN3O3S/c24-18-4-1-3-16(13-18)14-21-23(29)26-19-15-17(5-6-20(19)31-21)22(28)25-7-2-8-27-9-11-30-12-10-27/h1,3-6,13-15H,2,7-12H2,(H,25,28)(H,26,29)/p+1