[(2R)-1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[C@@H](C)OC(=O)CC2=CSC(=N2)C3=CN=CC=C3)C

InChI

InChI=1S/C21H20N2O3S/c1-13-6-7-16(9-14(13)2)20(25)15(3)26-19(24)10-18-12-27-21(23-18)17-5-4-8-22-11-17/h4-9,11-12,15H,10H2,1-3H3/t15-/m1/s1