(2,6-dimethylphenyl) 2-[3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl]sulfanylethanoate

Systemtic Name: (2,6-dimethylphenyl) 2-[3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl]sulfanylethanoate Openeye Name: (2,6-dimethylphenyl) 2-[[3-cyano-4,6-bis(4-methoxyphenyl)-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[3-cyano-4,6-bis(4-methoxyphenyl)-2-pyridinyl]thio]acetic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-[3-cyano-4,6-bis(4-methoxyphenyl)pyridin-2-yl]sulfanylacetate Traditional Name: 2-[[3-cyano-4,6-bis(4-methoxyphenyl)-2-pyridyl]thio]acetic acid (2,6-dimethylphenyl) ester Formula: C30H26N2O4S MolecularWeight: 510.60344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C30H26N2O4S/c1-19-6-5-7-20(2)29(19)36-28(33)18-37-30-26(17-31)25(21-8-12-23(34-3)13-9-21)16-27(32-30)22-10-14-24(35-4)15-11-22/h5-16H,18H2,1-4H3