N-(3-morpholin-4-ium-4-ylpropyl)-2-[3-oxidanylidene-2-(phenylmethylidene)-1,4-benzothiazin-4-yl]ethanamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-[3-oxidanylidene-2-(phenylmethylidene)-1,4-benzothiazin-4-yl]ethanamide Openeye Name: 2-(2-benzylidene-3-oxo-1,4-benzothiazin-4-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-2-[3-oxo-2-(phenylmethylene)-1,4-benzothiazin-4-yl]acetamide IUPAC Name: 2-(2-benzylidene-3-oxo-1,4-benzothiazin-4-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-(2-benzal-3-keto-1,4-benzothiazin-4-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C24H28N3O3S+ MolecularWeight: 438.56242

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)CN2C3=CC=CC=C3SC(=CC4=CC=CC=C4)C2=O

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)CN2C3=CC=CC=C3SC(=CC4=CC=CC=C4)C2=O

InChI

InChI=1S/C24H27N3O3S/c28-23(25-11-6-12-26-13-15-30-16-14-26)18-27-20-9-4-5-10-21(20)31-22(24(27)29)17-19-7-2-1-3-8-19/h1-5,7-10,17H,6,11-16,18H2,(H,25,28)/p+1