ethanoyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfamoyl]-4-methoxy-benzoate

Systemtic Name: ethanoyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfamoyl]-4-methoxy-benzoate Openeye Name: acetyl 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfamoyl]-4-methoxy-benzoate CAS Name: 3-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfamoyl]-4-methoxybenzoic acid acetyl ester IUPAC Name: acetyl 3-[(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfamoyl]-4-methoxybenzoate Traditional Name: 3-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfamoyl]-4-methoxy-benzoic acid acetyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OC(=O)C)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NS(=O)(=O)C3=C(C=CC(=C3)C(=O)OC(=O)C)OC

InChI

InChI=1S/C21H21N3O6S/c1-13-20(14(2)24(22-13)17-8-6-5-7-9-17)23-31(27,28)19-12-16(10-11-18(19)29-4)21(26)30-15(3)25/h5-12,23H,1-4H3