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

Systemtic Name: [2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-methylsulfonylpyrrolidine-2-carboxylate Openeye Name: [2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl 1-methylsulfonylpyrrolidine-2-carboxylate CAS Name: 1-methylsulfonyl-2-pyrrolidinecarboxylic acid [2-(2,3-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 1-methylsulfonylpyrrolidine-2-carboxylate Traditional Name: 1-mesylpyrrolidine-2-carboxylic acid [2-(2,3-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C18H22N2O6S2 MolecularWeight: 426.50708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)COC(=O)C3CCCN3S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)COC(=O)C3CCCN3S(=O)(=O)C

InChI

InChI=1S/C18H22N2O6S2/c1-24-15-8-4-6-13(16(15)25-2)17-19-12(11-27-17)10-26-18(21)14-7-5-9-20(14)28(3,22)23/h4,6,8,11,14H,5,7,9-10H2,1-3H3