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

Systemtic Name: (1-phenylpyrazol-4-yl)methyl 2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxylate Openeye Name: (1-phenylpyrazol-4-yl)methyl 2-(3,4-dimethoxyphenyl)thiazole-4-carboxylate CAS Name: 2-(3,4-dimethoxyphenyl)-4-thiazolecarboxylic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl 2-(3,4-dimethoxyphenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(3,4-dimethoxyphenyl)thiazole-4-carboxylic acid (1-phenylpyrazol-4-yl)methyl ester Formula: C22H19N3O4S MolecularWeight: 421.46896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)OCC3=CN(N=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)OCC3=CN(N=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H19N3O4S/c1-27-19-9-8-16(10-20(19)28-2)21-24-18(14-30-21)22(26)29-13-15-11-23-25(12-15)17-6-4-3-5-7-17/h3-12,14H,13H2,1-2H3