3-[2-azanylidene-6-(trifluoromethyloxy)-1,3-benzothiazol-3-yl]propanenitrile

Systemtic Name: 3-[2-azanylidene-6-(trifluoromethyloxy)-1,3-benzothiazol-3-yl]propanenitrile Openeye Name: 3-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]propanenitrile CAS Name: 3-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]propanenitrile IUPAC Name: 3-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]propanenitrile Traditional Name: 3-[2-imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]propionitrile Formula: C11H8F3N3OS MolecularWeight: 287.26093

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OC(F)(F)F)SC(=N)N2CCC#N

Isomeric SMILES

C1=CC2=C(C=C1OC(F)(F)F)SC(=N)N2CCC#N

InChI

InChI=1S/C11H8F3N3OS/c12-11(13,14)18-7-2-3-8-9(6-7)19-10(16)17(8)5-1-4-15/h2-3,6,16H,1,5H2