3-pyridin-4-yl-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]prop-2-enenitrile

Systemtic Name: 3-pyridin-4-yl-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]prop-2-enenitrile Openeye Name: 3-(4-pyridyl)-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]prop-2-enenitrile CAS Name: 3-pyridin-4-yl-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]-2-propenenitrile IUPAC Name: 3-pyridin-4-yl-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]prop-2-enenitrile Traditional Name: 3-(4-pyridyl)-2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]acrylonitrile Formula: C16H8F3N3S MolecularWeight: 331.31503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)N=C(S2)C(=CC3=CC=NC=C3)C#N

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)N=C(S2)C(=CC3=CC=NC=C3)C#N

InChI

InChI=1S/C16H8F3N3S/c17-16(18,19)12-1-2-14-13(8-12)22-15(23-14)11(9-20)7-10-3-5-21-6-4-10/h1-8H