3-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine trihydrochloride

Systemtic Name: 3-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine trihydrochloride Openeye Name: 3-[2-[4-(2-pyridyl)piperazin-1-yl]ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine trihydrochloride CAS Name: 3-[2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine trihydrochloride IUPAC Name: 3-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine trihydrochloride Traditional Name: [3-[2-[4-(2-pyridyl)piperazino]ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]amine trihydrochloride Formula: C19H23Cl3F3N5OS MolecularWeight: 532.83803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N)C4=CC=CC=N4.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N)C4=CC=CC=N4.Cl.Cl.Cl

InChI

InChI=1S/C19H20F3N5OS.3ClH/c20-19(21,22)28-14-4-5-15-16(13-14)29-18(23)27(15)12-9-25-7-10-26(11-8-25)17-3-1-2-6-24-17;;;/h1-6,13,23H,7-12H2;3*1H