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

Systemtic Name: diethyl-[3-[[2-[(3-methoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]propyl]azanium Openeye Name: diethyl-[3-[[2-[(3-methoxyphenyl)methylene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]propyl]ammonium CAS Name: diethyl-[3-[[[2-[(3-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazin-6-yl]-oxomethyl]amino]propyl]ammonium IUPAC Name: diethyl-[3-[[2-[(3-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]propyl]azanium Traditional Name: diethyl-[3-[(3-keto-2-m-anisylidene-4H-1,4-benzothiazine-6-carbonyl)amino]propyl]ammonium Formula: C24H30N3O3S+ MolecularWeight: 440.5783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O3S/c1-4-27(5-2)13-7-12-25-23(28)18-10-11-21-20(16-18)26-24(29)22(31-21)15-17-8-6-9-19(14-17)30-3/h6,8-11,14-16H,4-5,7,12-13H2,1-3H3,(H,25,28)(H,26,29)/p+1