methyl 3-[[(3-phenylimidazol-4-yl)carbonylamino]sulfamoyl]benzoate

Systemtic Name: methyl 3-[[(3-phenylimidazol-4-yl)carbonylamino]sulfamoyl]benzoate Openeye Name: methyl 3-[[(3-phenylimidazole-4-carbonyl)amino]sulfamoyl]benzoate CAS Name: 3-[[[oxo-(3-phenyl-4-imidazolyl)methyl]amino]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(3-phenylimidazole-4-carbonyl)amino]sulfamoyl]benzoate Traditional Name: 3-[[(3-phenylimidazole-4-carbonyl)amino]sulfamoyl]benzoic acid methyl ester Formula: C18H16N4O5S MolecularWeight: 400.40844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NNC(=O)C2=CN=CN2C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NNC(=O)C2=CN=CN2C3=CC=CC=C3

InChI

InChI=1S/C18H16N4O5S/c1-27-18(24)13-6-5-9-15(10-13)28(25,26)21-20-17(23)16-11-19-12-22(16)14-7-3-2-4-8-14/h2-12,21H,1H3,(H,20,23)