3-(2-tert-butylsulfanylethyl)-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine hydrochloride

Systemtic Name: 3-(2-tert-butylsulfanylethyl)-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine hydrochloride Openeye Name: 3-(2-tert-butylsulfanylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine hydrochloride CAS Name: 3-[2-(tert-butylthio)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine hydrochloride IUPAC Name: 3-(2-tert-butylsulfanylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine hydrochloride Traditional Name: [3-[2-(tert-butylthio)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]amine hydrochloride Formula: C14H18ClF3N2OS2 MolecularWeight: 386.88373

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCN1C2=C(C=C(C=C2)OC(F)(F)F)SC1=N.Cl

Isomeric SMILES

CC(C)(C)SCCN1C2=C(C=C(C=C2)OC(F)(F)F)SC1=N.Cl

InChI

InChI=1S/C14H17F3N2OS2.ClH/c1-13(2,3)21-7-6-19-10-5-4-9(20-14(15,16)17)8-11(10)22-12(19)18;/h4-5,8,18H,6-7H2,1-3H3;1H