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

Systemtic Name: methyl 3-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoate Openeye Name: methyl 3-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoate CAS Name: 3-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoate Traditional Name: 3-[[2-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid methyl ester Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2C3=NNC(=N3)C4CC4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NC2=CC=CC=C2C3=NNC(=N3)C4CC4

InChI

InChI=1S/C19H18N4O4S/c1-27-19(24)13-5-4-6-14(11-13)28(25,26)23-16-8-3-2-7-15(16)18-20-17(21-22-18)12-9-10-12/h2-8,11-12,23H,9-10H2,1H3,(H,20,21,22)