ethyl 5-[(4-bromanyl-3-methyl-phenyl)sulfamoyl]-1H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[(4-bromanyl-3-methyl-phenyl)sulfamoyl]-1H-pyrazole-3-carboxylate Openeye Name: ethyl 5-[(4-bromo-3-methyl-phenyl)sulfamoyl]-1H-pyrazole-3-carboxylate CAS Name: 5-[(4-bromo-3-methylphenyl)sulfamoyl]-1H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-bromo-3-methylphenyl)sulfamoyl]-1H-pyrazole-3-carboxylate Traditional Name: 5-[(4-bromo-3-methyl-phenyl)sulfamoyl]-1H-pyrazole-3-carboxylic acid ethyl ester Formula: C13H14BrN3O4S MolecularWeight: 388.23696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(=C1)S(=O)(=O)NC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)C1=NNC(=C1)S(=O)(=O)NC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C13H14BrN3O4S/c1-3-21-13(18)11-7-12(16-15-11)22(19,20)17-9-4-5-10(14)8(2)6-9/h4-7,17H,3H2,1-2H3,(H,15,16)