ethyl 4-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanylbutanoate

Systemtic Name: ethyl 4-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanylbutanoate Openeye Name: ethyl 4-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]butanoate CAS Name: 4-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanylbutanoate Traditional Name: 4-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]thio]butyric acid ethyl ester Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CCOC(=O)CCCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C25H24N2O3S/c1-3-30-24(28)10-7-15-31-25-22(17-26)21(18-11-13-20(29-2)14-12-18)16-23(27-25)19-8-5-4-6-9-19/h4-6,8-9,11-14,16H,3,7,10,15H2,1-2H3