2-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[3-(4-chloranylphenoxy)-2-oxidanyl-propyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[3-(4-chlorophenoxy)-2-hydroxy-propyl]sulfanyl-6-(2-thienyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[[3-(4-chlorophenoxy)-2-hydroxypropyl]thio]-6-thiophen-2-yl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[3-(4-chlorophenoxy)-2-hydroxypropyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[3-(4-chlorophenoxy)-2-hydroxy-propyl]thio]-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile Formula: C20H14ClF3N2O2S2 MolecularWeight: 470.91557

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(COC3=CC=C(C=C3)Cl)O

Isomeric SMILES

C1=CSC(=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(COC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H14ClF3N2O2S2/c21-12-3-5-14(6-4-12)28-10-13(27)11-30-19-15(9-25)16(20(22,23)24)8-17(26-19)18-2-1-7-29-18/h1-8,13,27H,10-11H2