dimethyl 5-(3-pyrazol-1-ylpropylsulfamoyl)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(3-pyrazol-1-ylpropylsulfamoyl)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(3-pyrazol-1-ylpropylsulfamoyl)benzene-1,3-dicarboxylate CAS Name: 5-[3-(1-pyrazolyl)propylsulfamoyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(3-pyrazol-1-ylpropylsulfamoyl)benzene-1,3-dicarboxylate Traditional Name: 5-(3-pyrazol-1-ylpropylsulfamoyl)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C16H19N3O6S MolecularWeight: 381.40356

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NCCCN2C=CC=N2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NCCCN2C=CC=N2)C(=O)OC

InChI

InChI=1S/C16H19N3O6S/c1-24-15(20)12-9-13(16(21)25-2)11-14(10-12)26(22,23)18-6-4-8-19-7-3-5-17-19/h3,5,7,9-11,18H,4,6,8H2,1-2H3