ethyl 2-[3-cyano-4-(4-fluorophenyl)-6-phenyl-pyridin-2-yl]sulfanylpropanoate

Systemtic Name: ethyl 2-[3-cyano-4-(4-fluorophenyl)-6-phenyl-pyridin-2-yl]sulfanylpropanoate Openeye Name: ethyl 2-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridyl]sulfanyl]propanoate CAS Name: 2-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridinyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[3-cyano-4-(4-fluorophenyl)-6-phenylpyridin-2-yl]sulfanylpropanoate Traditional Name: 2-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridyl]thio]propionic acid ethyl ester Formula: C23H19FN2O2S MolecularWeight: 406.472563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)F)C#N

Isomeric SMILES

CCOC(=O)C(C)SC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C23H19FN2O2S/c1-3-28-23(27)15(2)29-22-20(14-25)19(16-9-11-18(24)12-10-16)13-21(26-22)17-7-5-4-6-8-17/h4-13,15H,3H2,1-2H3