(5-ethanoyl-2-ethoxy-phenyl)methyl 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 2-[2-(3-pyridyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-pyridinyl)-4-thiazolyl]acetic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(3-pyridyl)thiazol-4-yl]acetic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CC2=CSC(=N2)C3=CN=CC=C3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)CC2=CSC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C21H20N2O4S/c1-3-26-19-7-6-15(14(2)24)9-17(19)12-27-20(25)10-18-13-28-21(23-18)16-5-4-8-22-11-16/h4-9,11,13H,3,10,12H2,1-2H3