2-(phenylmethylsulfanyl)-6-thiophen-2-yl-5-[2,2,2-tris(fluoranyl)ethanoyl]pyridine-3-carbonitrile

Systemtic Name: 2-(phenylmethylsulfanyl)-6-thiophen-2-yl-5-[2,2,2-tris(fluoranyl)ethanoyl]pyridine-3-carbonitrile Openeye Name: 2-benzylsulfanyl-6-(2-thienyl)-5-(2,2,2-trifluoroacetyl)pyridine-3-carbonitrile CAS Name: 2-(phenylmethylthio)-6-thiophen-2-yl-5-(2,2,2-trifluoro-1-oxoethyl)-3-pyridinecarbonitrile IUPAC Name: 2-benzylsulfanyl-6-thiophen-2-yl-5-(2,2,2-trifluoroacetyl)pyridine-3-carbonitrile Traditional Name: 2-(benzylthio)-6-(2-thienyl)-5-(2,2,2-trifluoroacetyl)nicotinonitrile Formula: C19H11F3N2OS2 MolecularWeight: 404.42865

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=C(C=C2C#N)C(=O)C(F)(F)F)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=C(C=C2C#N)C(=O)C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C19H11F3N2OS2/c20-19(21,22)17(25)14-9-13(10-23)18(24-16(14)15-7-4-8-26-15)27-11-12-5-2-1-3-6-12/h1-9H,11H2