4-[2-(1H-imidazol-3-ium-3-yl)-2-oxidanylidene-ethyl]-2-[(4-methylphenyl)methylidene]-1,4-benzothiazin-3-one

Systemtic Name: 4-[2-(1H-imidazol-3-ium-3-yl)-2-oxidanylidene-ethyl]-2-[(4-methylphenyl)methylidene]-1,4-benzothiazin-3-one Openeye Name: 4-[2-(1H-imidazol-3-ium-3-yl)-2-oxo-ethyl]-2-(p-tolylmethylene)-1,4-benzothiazin-3-one CAS Name: 4-[2-(1H-imidazol-3-ium-3-yl)-2-oxoethyl]-2-[(4-methylphenyl)methylidene]-1,4-benzothiazin-3-one IUPAC Name: 4-[2-(1H-imidazol-3-ium-3-yl)-2-oxoethyl]-2-[(4-methylphenyl)methylidene]-1,4-benzothiazin-3-one Traditional Name: 4-[2-(1H-imidazol-3-ium-3-yl)-2-keto-ethyl]-2-(4-methylbenzylidene)-1,4-benzothiazin-3-one Formula: C21H18N3O2S+ MolecularWeight: 376.45152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=O)N(C3=CC=CC=C3S2)CC(=O)[N+]4=CNC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C=C2C(=O)N(C3=CC=CC=C3S2)CC(=O)[N+]4=CNC=C4

InChI

InChI=1S/C21H17N3O2S/c1-15-6-8-16(9-7-15)12-19-21(26)24(13-20(25)23-11-10-22-14-23)17-4-2-3-5-18(17)27-19/h2-12,14H,13H2,1H3/p+1