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

Systemtic Name: butyl-methyl-[3-[(2-morpholin-4-ium-4-yl-3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]propyl]azanium Openeye Name: butyl-methyl-[3-[(2-morpholin-4-ium-4-yl-3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]propyl]ammonium CAS Name: butyl-methyl-[3-[[[2-(4-morpholin-4-iumyl)-3-oxo-4H-1,4-benzothiazin-6-yl]-oxomethyl]amino]propyl]ammonium IUPAC Name: butyl-methyl-[3-[(2-morpholin-4-ium-4-yl-3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]propyl]azanium Traditional Name: butyl-[3-[(3-keto-2-morpholin-4-ium-4-yl-4H-1,4-benzothiazine-6-carbonyl)amino]propyl]-methyl-ammonium Formula: C21H34N4O3S+2 MolecularWeight: 422.58466

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CCCNC(=O)C1=CC2=C(C=C1)SC(C(=O)N2)[NH+]3CCOCC3

Isomeric SMILES

CCCC[NH+](C)CCCNC(=O)C1=CC2=C(C=C1)SC(C(=O)N2)[NH+]3CCOCC3

InChI

InChI=1S/C21H32N4O3S/c1-3-4-9-24(2)10-5-8-22-19(26)16-6-7-18-17(15-16)23-20(27)21(29-18)25-11-13-28-14-12-25/h6-7,15,21H,3-5,8-14H2,1-2H3,(H,22,26)(H,23,27)/p+2