methyl 4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]benzoate

Systemtic Name: methyl 4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]benzoate Openeye Name: methyl 4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]benzoate CAS Name: 4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]benzoate Traditional Name: 4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]benzoic acid methyl ester Formula: C21H29N3O6S2 MolecularWeight: 483.60146

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H29N3O6S2/c1-5-14-22-19-13-12-18(32(28,29)24(6-2)7-3)15-20(19)23-31(26,27)17-10-8-16(9-11-17)21(25)30-4/h8-13,15,22-23H,5-7,14H2,1-4H3