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

Systemtic Name: ethyl 3-[(4-bromophenyl)methyl-methyl-sulfamoyl]-5-methyl-1H-pyrazole-4-carboxylate Openeye Name: ethyl 3-[(4-bromophenyl)methyl-methyl-sulfamoyl]-5-methyl-1H-pyrazole-4-carboxylate CAS Name: 3-[(4-bromophenyl)methyl-methylsulfamoyl]-5-methyl-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-bromophenyl)methyl-methylsulfamoyl]-5-methyl-1H-pyrazole-4-carboxylate Traditional Name: 3-[(4-bromobenzyl)-methyl-sulfamoyl]-5-methyl-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C15H18BrN3O4S MolecularWeight: 416.29012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1S(=O)(=O)N(C)CC2=CC=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)C1=C(NN=C1S(=O)(=O)N(C)CC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C15H18BrN3O4S/c1-4-23-15(20)13-10(2)17-18-14(13)24(21,22)19(3)9-11-5-7-12(16)8-6-11/h5-8H,4,9H2,1-3H3,(H,17,18)