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

Systemtic Name: 2-[(2-fluorophenyl)methylidene]-3-oxidanylidene-N-(pyridin-1-ium-3-ylmethyl)-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 2-[(2-fluorophenyl)methylene]-3-oxo-N-(pyridin-1-ium-3-ylmethyl)-4H-1,4-benzothiazine-6-carboxamide CAS Name: 2-[(2-fluorophenyl)methylidene]-3-oxo-N-(3-pyridin-1-iumylmethyl)-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 2-[(2-fluorophenyl)methylidene]-3-oxo-N-(pyridin-1-ium-3-ylmethyl)-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 2-(2-fluorobenzylidene)-3-keto-N-(pyridin-1-ium-3-ylmethyl)-4H-1,4-benzothiazine-6-carboxamide Formula: C22H17FN3O2S+ MolecularWeight: 406.452683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCC4=C[NH+]=CC=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)C=C2C(=O)NC3=C(S2)C=CC(=C3)C(=O)NCC4=C[NH+]=CC=C4)F

InChI

InChI=1S/C22H16FN3O2S/c23-17-6-2-1-5-15(17)11-20-22(28)26-18-10-16(7-8-19(18)29-20)21(27)25-13-14-4-3-9-24-12-14/h1-12H,13H2,(H,25,27)(H,26,28)/p+1