3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[(4-sulfamoylphenyl)methyl]propanamide

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[(4-sulfamoylphenyl)methyl]propanamide Openeye Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[(4-sulfamoylphenyl)methyl]propanamide CAS Name: 3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[(4-sulfamoylphenyl)methyl]propanamide IUPAC Name: 3-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[(4-sulfamoylphenyl)methyl]propanamide Traditional Name: 3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-(4-sulfamoylbenzyl)propionamide Formula: C15H19BrN4O3S MolecularWeight: 415.30536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C)Br

InChI

InChI=1S/C15H19BrN4O3S/c1-10-15(16)11(2)20(19-10)8-7-14(21)18-9-12-3-5-13(6-4-12)24(17,22)23/h3-6H,7-9H2,1-2H3,(H,18,21)(H2,17,22,23)