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

Systemtic Name: butyl-[3-[[2-[(4-methoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]propyl]-methyl-azanium Openeye Name: butyl-[3-[[2-[(4-methoxyphenyl)methylene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]propyl]-methyl-ammonium CAS Name: butyl-[3-[[[2-[(4-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazin-6-yl]-oxomethyl]amino]propyl]-methylammonium IUPAC Name: butyl-[3-[[2-[(4-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]propyl]-methylazanium Traditional Name: butyl-[3-[(3-keto-2-p-anisylidene-4H-1,4-benzothiazine-6-carbonyl)amino]propyl]-methyl-ammonium Formula: C25H32N3O3S+ MolecularWeight: 454.60488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O3S/c1-4-5-14-28(2)15-6-13-26-24(29)19-9-12-22-21(17-19)27-25(30)23(32-22)16-18-7-10-20(31-3)11-8-18/h7-12,16-17H,4-6,13-15H2,1-3H3,(H,26,29)(H,27,30)/p+1