(2-cyanophenyl)methyl 2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: (2-cyanophenyl)methyl 2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxylate Openeye Name: (2-cyanophenyl)methyl 2-(3,4-dimethoxyphenyl)thiazole-4-carboxylate CAS Name: 2-(3,4-dimethoxyphenyl)-4-thiazolecarboxylic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(3,4-dimethoxyphenyl)thiazole-4-carboxylic acid (2-cyanobenzyl) ester Formula: C20H16N2O4S MolecularWeight: 380.41704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)OCC3=CC=CC=C3C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)OCC3=CC=CC=C3C#N)OC

InChI

InChI=1S/C20H16N2O4S/c1-24-17-8-7-13(9-18(17)25-2)19-22-16(12-27-19)20(23)26-11-15-6-4-3-5-14(15)10-21/h3-9,12H,11H2,1-2H3