2-azanyl-4-(4-chlorophenyl)-6-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(4-chlorophenyl)-6-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(4-chlorophenyl)-6-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(4-chlorophenyl)-6-[[2-(4-fluorophenyl)-2-oxoethyl]thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(4-chlorophenyl)-6-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(4-chlorophenyl)-6-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]dinicotinonitrile Formula: C21H12ClFN4OS MolecularWeight: 422.862583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)F)N)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)F)N)C#N)Cl

InChI

InChI=1S/C21H12ClFN4OS/c22-14-5-1-13(2-6-14)19-16(9-24)20(26)27-21(17(19)10-25)29-11-18(28)12-3-7-15(23)8-4-12/h1-8H,11H2,(H2,26,27)