N-(2-morpholin-4-ium-4-ylethyl)-3-oxidanylidene-2-(phenylmethylidene)-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-3-oxidanylidene-2-(phenylmethylidene)-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 2-benzylidene-N-(2-morpholin-4-ium-4-ylethyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-3-oxo-2-(phenylmethylene)-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 2-benzylidene-N-(2-morpholin-4-ium-4-ylethyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 2-benzal-3-keto-N-(2-morpholin-4-ium-4-ylethyl)-4H-1,4-benzothiazine-6-carboxamide Formula: C22H24N3O3S+ MolecularWeight: 410.50926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S/c26-21(23-8-9-25-10-12-28-13-11-25)17-6-7-19-18(15-17)24-22(27)20(29-19)14-16-4-2-1-3-5-16/h1-7,14-15H,8-13H2,(H,23,26)(H,24,27)/p+1