[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl] 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl] 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] 2-[2-(3-pyridyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-pyridinyl)-4-thiazolyl]acetic acid [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylphenyl)ethyl] 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(3-pyridyl)thiazol-4-yl]acetic acid (2-keto-2-mesityl-ethyl) ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)COC(=O)CC2=CSC(=N2)C3=CN=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)COC(=O)CC2=CSC(=N2)C3=CN=CC=C3)C

InChI

InChI=1S/C21H20N2O3S/c1-13-7-14(2)20(15(3)8-13)18(24)11-26-19(25)9-17-12-27-21(23-17)16-5-4-6-22-10-16/h4-8,10,12H,9,11H2,1-3H3