4-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylbutanoic acid

Systemtic Name: 4-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylbutanoic acid Openeye Name: 4-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]butanoic acid CAS Name: 4-[[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)-2-pyridinyl]thio]butanoic acid IUPAC Name: 4-[3-cyano-6-thiophen-2-yl-4-(trifluoromethyl)pyridin-2-yl]sulfanylbutanoic acid Traditional Name: 4-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridyl]thio]butyric acid Formula: C15H11F3N2O2S2 MolecularWeight: 372.38525

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCCCC(=O)O

InChI

InChI=1S/C15H11F3N2O2S2/c16-15(17,18)10-7-11(12-3-1-5-23-12)20-14(9(10)8-19)24-6-2-4-13(21)22/h1,3,5,7H,2,4,6H2,(H,21,22)