3-[2-(3-phenylpropylsulfinyl)ethyl]-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine

Systemtic Name: 3-[2-(3-phenylpropylsulfinyl)ethyl]-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine Openeye Name: 3-[2-(3-phenylpropylsulfinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine CAS Name: 3-[2-(3-phenylpropylsulfinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine IUPAC Name: 3-[2-(3-phenylpropylsulfinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine Traditional Name: [3-[2-(3-phenylpropylsulfinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]amine Formula: C19H19F3N2O2S2 MolecularWeight: 428.49157

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCS(=O)CCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N

Isomeric SMILES

C1=CC=C(C=C1)CCCS(=O)CCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N

InChI

InChI=1S/C19H19F3N2O2S2/c20-19(21,22)26-15-8-9-16-17(13-15)27-18(23)24(16)10-12-28(25)11-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,13,23H,4,7,10-12H2