methyl 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-4-pyrazolyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[(1-homoveratrylpyrazol-4-yl)sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C19H21N3O6S2 MolecularWeight: 451.51654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C=C(C=N2)NS(=O)(=O)C3=C(SC=C3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C=C(C=N2)NS(=O)(=O)C3=C(SC=C3)C(=O)OC)OC

InChI

InChI=1S/C19H21N3O6S2/c1-26-15-5-4-13(10-16(15)27-2)6-8-22-12-14(11-20-22)21-30(24,25)17-7-9-29-18(17)19(23)28-3/h4-5,7,9-12,21H,6,8H2,1-3H3