ethyl 4-[[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]sulfamoyl]benzoate

Systemtic Name: ethyl 4-[[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]sulfamoyl]benzoate Openeye Name: ethyl 4-[[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]sulfamoyl]benzoate CAS Name: 4-[[2-[[3-(1-imidazolyl)propylamino]-oxomethyl]phenyl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]sulfamoyl]benzoate Traditional Name: 4-[[2-(3-imidazol-1-ylpropylcarbamoyl)phenyl]sulfamoyl]benzoic acid ethyl ester Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCCCN3C=CN=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C22H24N4O5S/c1-2-31-22(28)17-8-10-18(11-9-17)32(29,30)25-20-7-4-3-6-19(20)21(27)24-12-5-14-26-15-13-23-16-26/h3-4,6-11,13,15-16,25H,2,5,12,14H2,1H3,(H,24,27)