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

Systemtic Name: [2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: [2-(4-tert-butylphenyl)-2-oxo-ethyl] 2-[2-(2-pyridyl)thiazol-4-yl]acetate CAS Name: 2-[2-(2-pyridinyl)-4-thiazolyl]acetic acid [2-(4-tert-butylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-tert-butylphenyl)-2-oxoethyl] 2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(2-pyridyl)thiazol-4-yl]acetic acid [2-(4-tert-butylphenyl)-2-keto-ethyl] ester Formula: C22H22N2O3S MolecularWeight: 394.48668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)COC(=O)CC2=CSC(=N2)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)COC(=O)CC2=CSC(=N2)C3=CC=CC=N3

InChI

InChI=1S/C22H22N2O3S/c1-22(2,3)16-9-7-15(8-10-16)19(25)13-27-20(26)12-17-14-28-21(24-17)18-6-4-5-11-23-18/h4-11,14H,12-13H2,1-3H3