3-ethyl-2-[3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)-2-(trifluoromethyl)prop-2-enylidene]-1,3-benzothiazole

Systemtic Name: 3-ethyl-2-[3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)-2-(trifluoromethyl)prop-2-enylidene]-1,3-benzothiazole Openeye Name: 3-ethyl-2-[3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)-2-(trifluoromethyl)prop-2-enylidene]-1,3-benzothiazole CAS Name: 3-ethyl-2-[3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)-2-(trifluoromethyl)prop-2-enylidene]-1,3-benzothiazole IUPAC Name: 3-ethyl-2-[3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)-2-(trifluoromethyl)prop-2-enylidene]-1,3-benzothiazole Traditional Name: 3-ethyl-2-[3-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)-2-(trifluoromethyl)prop-2-enylidene]-1,3-benzothiazole Formula: C22H20F3N2S2+ MolecularWeight: 433.53281

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=CC(=CC3=[N+](C4=CC=CC=C4S3)CC)C(F)(F)F

Isomeric SMILES

CCN1C2=CC=CC=C2SC1=CC(=CC3=[N+](C4=CC=CC=C4S3)CC)C(F)(F)F

InChI

InChI=1S/C22H20F3N2S2/c1-3-26-16-9-5-7-11-18(16)28-20(26)13-15(22(23,24)25)14-21-27(4-2)17-10-6-8-12-19(17)29-21/h5-14H,3-4H2,1-2H3/q+1