N-(3-morpholin-4-ium-4-ylpropyl)-4-[(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-[(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide Traditional Name: 4-[(3-keto-4H-1,4-benzothiazin-2-ylidene)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C23H26N3O3S+ MolecularWeight: 424.53584

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC=C(C=C2)C=C3C(=O)NC4=CC=CC=C4S3

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC=C(C=C2)C=C3C(=O)NC4=CC=CC=C4S3

InChI

InChI=1S/C23H25N3O3S/c27-22(24-10-3-11-26-12-14-29-15-13-26)18-8-6-17(7-9-18)16-21-23(28)25-19-4-1-2-5-20(19)30-21/h1-2,4-9,16H,3,10-15H2,(H,24,27)(H,25,28)/p+1