(2-bromanyl-4-cyano-6-ethoxy-phenyl) 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]ethanoate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 2-[2-(4-methoxyphenyl)thiazol-4-yl]acetate CAS Name: 2-[2-(4-methoxyphenyl)-4-thiazolyl]acetic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(4-methoxyphenyl)thiazol-4-yl]acetic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C21H17BrN2O4S MolecularWeight: 473.33968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)CC2=CSC(=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)CC2=CSC(=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H17BrN2O4S/c1-3-27-18-9-13(11-23)8-17(22)20(18)28-19(25)10-15-12-29-21(24-15)14-4-6-16(26-2)7-5-14/h4-9,12H,3,10H2,1-2H3