[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-phenylpyrazole-4-carboxylate

Systemtic Name: [2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-phenylpyrazole-4-carboxylate Openeye Name: [2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl 1-phenylpyrazole-4-carboxylate CAS Name: 1-phenyl-4-pyrazolecarboxylic acid [2-(2,3-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-phenylpyrazole-4-carboxylate Traditional Name: 1-phenylpyrazole-4-carboxylic acid [2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)COC(=O)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)COC(=O)C3=CN(N=C3)C4=CC=CC=C4

InChI

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