2-[[(4-fluorophenyl)amino]-phenacylsulfanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[(4-fluorophenyl)amino]-phenacylsulfanyl-methylidene]propanedinitrile Openeye Name: 2-[(4-fluoroanilino)-phenacylsulfanyl-methylene]propanedinitrile CAS Name: 2-[(4-fluoroanilino)-(phenacylthio)methylidene]propanedinitrile IUPAC Name: 2-[(4-fluoroanilino)-phenacylsulfanylmethylidene]propanedinitrile Traditional Name: 2-[(4-fluoroanilino)-(phenacylthio)methylene]malononitrile Formula: C18H12FN3OS MolecularWeight: 337.370783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12FN3OS/c19-15-6-8-16(9-7-15)22-18(14(10-20)11-21)24-12-17(23)13-4-2-1-3-5-13/h1-9,22H,12H2