2-[4-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]ethanenitrile

Systemtic Name: 2-[4-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]ethanenitrile Openeye Name: 2-[4-[2-(trifluoromethyl)phenyl]thiazol-2-yl]acetonitrile CAS Name: 2-[4-[2-(trifluoromethyl)phenyl]-2-thiazolyl]acetonitrile IUPAC Name: 2-[4-[2-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]acetonitrile Traditional Name: 2-[4-[2-(trifluoromethyl)phenyl]thiazol-2-yl]acetonitrile Formula: C12H7F3N2S MolecularWeight: 268.25759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CSC(=N2)CC#N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CSC(=N2)CC#N)C(F)(F)F

InChI

InChI=1S/C12H7F3N2S/c13-12(14,15)9-4-2-1-3-8(9)10-7-18-11(17-10)5-6-16/h1-4,7H,5H2