propan-2-yl 2-[4,6-bis(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[4,6-bis(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[[4,6-bis(4-chlorophenyl)-3-cyano-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[4,6-bis(4-chlorophenyl)-3-cyano-2-pyridinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[4,6-bis(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanylacetate Traditional Name: 2-[[4,6-bis(4-chlorophenyl)-3-cyano-2-pyridyl]thio]acetic acid isopropyl ester Formula: C23H18Cl2N2O2S MolecularWeight: 457.37222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18Cl2N2O2S/c1-14(2)29-22(28)13-30-23-20(12-26)19(15-3-7-17(24)8-4-15)11-21(27-23)16-5-9-18(25)10-6-16/h3-11,14H,13H2,1-2H3