[5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]methyl methanesulfonate

Systemtic Name: [5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]methyl methanesulfonate Openeye Name: [5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)-3-pyrazolyl]methyl ester IUPAC Name: [5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [5-(4-chlorophenyl)-1-(4-sulfamoylphenyl)pyrazol-3-yl]methyl ester Formula: C17H16ClN3O5S2 MolecularWeight: 441.90904

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CS(=O)(=O)OCC1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C17H16ClN3O5S2/c1-27(22,23)26-11-14-10-17(12-2-4-13(18)5-3-12)21(20-14)15-6-8-16(9-7-15)28(19,24)25/h2-10H,11H2,1H3,(H2,19,24,25)