2-[(3-chlorophenyl)methylidene]-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)methylidene]-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 2-[(3-chlorophenyl)methylene]-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: 2-[(3-chlorophenyl)methylidene]-N-[2-(2-methyl-1-piperidin-1-iumyl)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 2-[(3-chlorophenyl)methylidene]-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 2-(3-chlorobenzylidene)-3-keto-N-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-4H-1,4-benzothiazine-6-carboxamide Formula: C24H27ClN3O2S+ MolecularWeight: 457.00808

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC(=CC=C4)Cl)C(=O)N3

Isomeric SMILES

CC1CCCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC(=CC=C4)Cl)C(=O)N3

InChI

InChI=1S/C24H26ClN3O2S/c1-16-5-2-3-11-28(16)12-10-26-23(29)18-8-9-21-20(15-18)27-24(30)22(31-21)14-17-6-4-7-19(25)13-17/h4,6-9,13-16H,2-3,5,10-12H2,1H3,(H,26,29)(H,27,30)/p+1