phenyl 5-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: phenyl 5-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: phenyl 5-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-2-furancarboxylic acid phenyl ester IUPAC Name: phenyl 5-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[5-(trifluoromethyl)-2-pyridyl]thio]methyl]furan-2-carboxylic acid phenyl ester Formula: C18H12F3NO3S MolecularWeight: 379.35299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=CC=C(O2)CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=CC=C(O2)CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H12F3NO3S/c19-18(20,21)12-6-9-16(22-10-12)26-11-14-7-8-15(24-14)17(23)25-13-4-2-1-3-5-13/h1-10H,11H2