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

Systemtic Name: methyl 5-bromanyl-2-[[2-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoate Openeye Name: methyl 5-bromo-2-[[2-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoate CAS Name: 5-bromo-2-[[2-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[[2-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoate Traditional Name: 5-bromo-2-[[2-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]sulfamoyl]benzoic acid methyl ester Formula: C17H15BrN4O4S MolecularWeight: 451.2944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)C2=CC=CC=C2NS(=O)(=O)C3=C(C=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CC1=NC(=NN1)C2=CC=CC=C2NS(=O)(=O)C3=C(C=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C17H15BrN4O4S/c1-10-19-16(21-20-10)12-5-3-4-6-14(12)22-27(24,25)15-8-7-11(18)9-13(15)17(23)26-2/h3-9,22H,1-2H3,(H,19,20,21)