[2-acetyloxy-4-[2-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylethanoyl]phenyl] ethanoate

Systemtic Name: [2-acetyloxy-4-[2-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylethanoyl]phenyl] ethanoate Openeye Name: [2-acetoxy-4-[2-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]acetyl]phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-[2-[(3-cyano-6-phenyl-2-pyridinyl)thio]-1-oxoethyl]phenyl] ester IUPAC Name: [2-acetyloxy-4-[2-(3-cyano-6-phenylpyridin-2-yl)sulfanylacetyl]phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-[2-[(3-cyano-6-phenyl-2-pyridyl)thio]acetyl]phenyl] ester Formula: C24H18N2O5S MolecularWeight: 446.47512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(=O)CSC2=C(C=CC(=N2)C3=CC=CC=C3)C#N)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(=O)CSC2=C(C=CC(=N2)C3=CC=CC=C3)C#N)OC(=O)C

InChI

InChI=1S/C24H18N2O5S/c1-15(27)30-22-11-9-18(12-23(22)31-16(2)28)21(29)14-32-24-19(13-25)8-10-20(26-24)17-6-4-3-5-7-17/h3-12H,14H2,1-2H3