[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanoate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetate CAS Name: 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)thio]acetic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetate Traditional Name: 2-[(3-cyano-6-keto-4-methyl-1H-pyridin-2-yl)thio]acetic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C20H20N2O4S MolecularWeight: 384.4488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)CSC2=C(C(=CC(=O)N2)C)C#N)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)CSC2=C(C(=CC(=O)N2)C)C#N)C)C

InChI

InChI=1S/C20H20N2O4S/c1-11-5-13(3)15(6-12(11)2)17(23)9-26-19(25)10-27-20-16(8-21)14(4)7-18(24)22-20/h5-7H,9-10H2,1-4H3,(H,22,24)