butyl-ethyl-[3-[[2-[(3-methoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]propyl]azanium

Systemtic Name: butyl-ethyl-[3-[[2-[(3-methoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]propyl]azanium Openeye Name: butyl-ethyl-[3-[[2-[(3-methoxyphenyl)methylene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]propyl]ammonium CAS Name: butyl-ethyl-[3-[[[2-[(3-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazin-6-yl]-oxomethyl]amino]propyl]ammonium IUPAC Name: butyl-ethyl-[3-[[2-[(3-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]propyl]azanium Traditional Name: butyl-ethyl-[3-[(3-keto-2-m-anisylidene-4H-1,4-benzothiazine-6-carbonyl)amino]propyl]ammonium Formula: C26H34N3O3S+ MolecularWeight: 468.63146

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)CCCNC(=O)C1=CC2=C(C=C1)SC(=CC3=CC(=CC=C3)OC)C(=O)N2

Isomeric SMILES

CCCC[NH+](CC)CCCNC(=O)C1=CC2=C(C=C1)SC(=CC3=CC(=CC=C3)OC)C(=O)N2

InChI

InChI=1S/C26H33N3O3S/c1-4-6-14-29(5-2)15-8-13-27-25(30)20-11-12-23-22(18-20)28-26(31)24(33-23)17-19-9-7-10-21(16-19)32-3/h7,9-12,16-18H,4-6,8,13-15H2,1-3H3,(H,27,30)(H,28,31)/p+1