2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4,6-bis(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4,6-bis(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4,6-bis(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4,6-bis(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4,6-bis(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4,6-bis(trifluoromethyl)nicotinonitrile Formula: C17H10F6N2O2S MolecularWeight: 420.328919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=C(C(=CC(=N2)C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=C(C(=CC(=N2)C(F)(F)F)C(F)(F)F)C#N

InChI

InChI=1S/C17H10F6N2O2S/c1-27-10-4-2-9(3-5-10)13(26)8-28-15-11(7-24)12(16(18,19)20)6-14(25-15)17(21,22)23/h2-6H,8H2,1H3