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

Systemtic Name: 4-methyl-3-[[(3-phenylimidazol-4-yl)carbonylamino]sulfamoyl]benzoate Openeye Name: 4-methyl-3-[[(3-phenylimidazole-4-carbonyl)amino]sulfamoyl]benzoate CAS Name: 4-methyl-3-[[[oxo-(3-phenyl-4-imidazolyl)methyl]amino]sulfamoyl]benzoate IUPAC Name: 4-methyl-3-[[(3-phenylimidazole-4-carbonyl)amino]sulfamoyl]benzoate Traditional Name: 4-methyl-3-[[(3-phenylimidazole-4-carbonyl)amino]sulfamoyl]benzoate Formula: C18H15N4O5S- MolecularWeight: 399.4005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)NNC(=O)C2=CN=CN2C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)NNC(=O)C2=CN=CN2C3=CC=CC=C3

InChI

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