ethyl 4-[[4-(5-acetamido-3-methyl-pyrazol-1-yl)phenyl]sulfamoyl]benzoate

Systemtic Name: ethyl 4-[[4-(5-acetamido-3-methyl-pyrazol-1-yl)phenyl]sulfamoyl]benzoate Openeye Name: ethyl 4-[[4-(5-acetamido-3-methyl-pyrazol-1-yl)phenyl]sulfamoyl]benzoate CAS Name: 4-[[4-(5-acetamido-3-methyl-1-pyrazolyl)phenyl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(5-acetamido-3-methylpyrazol-1-yl)phenyl]sulfamoyl]benzoate Traditional Name: 4-[[4-(5-acetamido-3-methyl-pyrazol-1-yl)phenyl]sulfamoyl]benzoic acid ethyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C)NC(=O)C

InChI

InChI=1S/C21H22N4O5S/c1-4-30-21(27)16-5-11-19(12-6-16)31(28,29)24-17-7-9-18(10-8-17)25-20(22-15(3)26)13-14(2)23-25/h5-13,24H,4H2,1-3H3,(H,22,26)