2-[[(3-fluorophenyl)amino]-(phenylmethylsulfanyl)methylidene]propanedinitrile

Systemtic Name: 2-[[(3-fluorophenyl)amino]-(phenylmethylsulfanyl)methylidene]propanedinitrile Openeye Name: 2-[benzylsulfanyl-(3-fluoroanilino)methylene]propanedinitrile CAS Name: 2-[(3-fluoroanilino)-(phenylmethylthio)methylidene]propanedinitrile IUPAC Name: 2-[benzylsulfanyl-(3-fluoroanilino)methylidene]propanedinitrile Traditional Name: 2-[(benzylthio)-(3-fluoroanilino)methylene]malononitrile Formula: C17H12FN3S MolecularWeight: 309.360683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12FN3S/c18-15-7-4-8-16(9-15)21-17(14(10-19)11-20)22-12-13-5-2-1-3-6-13/h1-9,21H,12H2