2-[[(4-fluorophenyl)amino]-(pyridin-3-ylmethylsulfanyl)methylidene]propanedinitrile

Systemtic Name: 2-[[(4-fluorophenyl)amino]-(pyridin-3-ylmethylsulfanyl)methylidene]propanedinitrile Openeye Name: 2-[(4-fluoroanilino)-(3-pyridylmethylsulfanyl)methylene]propanedinitrile CAS Name: 2-[(4-fluoroanilino)-(3-pyridinylmethylthio)methylidene]propanedinitrile IUPAC Name: 2-[(4-fluoroanilino)-(pyridin-3-ylmethylsulfanyl)methylidene]propanedinitrile Traditional Name: 2-[(4-fluoroanilino)-(3-pyridylmethylthio)methylene]malononitrile Formula: C16H11FN4S MolecularWeight: 310.348743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC(=C(C#N)C#N)NC2=CC=C(C=C2)F

Isomeric SMILES

C1=CC(=CN=C1)CSC(=C(C#N)C#N)NC2=CC=C(C=C2)F

InChI

InChI=1S/C16H11FN4S/c17-14-3-5-15(6-4-14)21-16(13(8-18)9-19)22-11-12-2-1-7-20-10-12/h1-7,10,21H,11H2