3-[4-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]phenyl]propanoate

Systemtic Name: 3-[4-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]phenyl]propanoate Openeye Name: 3-[4-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]phenyl]propanoate CAS Name: 3-[4-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]phenyl]propanoate IUPAC Name: 3-[4-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]phenyl]propanoate Traditional Name: 3-[4-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]phenyl]propionate Formula: C20H19N4O4S- MolecularWeight: 411.45426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)CCC(=O)[O-]

Isomeric SMILES

C1CC1C2=NC(=NN2)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)CCC(=O)[O-]

InChI

InChI=1S/C20H20N4O4S/c25-18(26)12-7-13-5-10-15(11-6-13)29(27,28)24-17-4-2-1-3-16(17)20-21-19(22-23-20)14-8-9-14/h1-6,10-11,14,24H,7-9,12H2,(H,25,26)(H,21,22,23)/p-1