(4-pyrazol-1-ylphenyl)methyl 2-bromanyl-5-[methoxy(methyl)sulfamoyl]benzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 2-bromanyl-5-[methoxy(methyl)sulfamoyl]benzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 2-bromo-5-[methoxy(methyl)sulfamoyl]benzoate CAS Name: 2-bromo-5-[methoxy(methyl)sulfamoyl]benzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 2-bromo-5-[methoxy(methyl)sulfamoyl]benzoate Traditional Name: 2-bromo-5-[methoxy(methyl)sulfamoyl]benzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C19H18BrN3O5S MolecularWeight: 480.33232

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Descriptors Computed from Structure

Canonical SMILES:

CN(OC)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CN(OC)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C19H18BrN3O5S/c1-22(27-2)29(25,26)16-8-9-18(20)17(12-16)19(24)28-13-14-4-6-15(7-5-14)23-11-3-10-21-23/h3-12H,13H2,1-2H3