propan-2-yl 4-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: propan-2-yl 4-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: isopropyl 4-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-3-oxo-butanoate CAS Name: 4-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]-3-oxobutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-3-oxobutanoate Traditional Name: 4-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]thio]-3-keto-butyric acid isopropyl ester Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(=O)CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC(C)OC(=O)CC(=O)CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C26H24N2O4S/c1-17(2)32-25(30)13-20(29)16-33-26-23(15-27)22(18-9-11-21(31-3)12-10-18)14-24(28-26)19-7-5-4-6-8-19/h4-12,14,17H,13,16H2,1-3H3