N-[(3-bromophenyl)methyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide

Systemtic Name: N-[(3-bromophenyl)methyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide Openeye Name: N-[(3-bromophenyl)methyl]-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide CAS Name: N-[(3-bromophenyl)methyl]-3,5-dimethyl-1-phenyl-4-pyrazolesulfonamide IUPAC Name: N-[(3-bromophenyl)methyl]-3,5-dimethyl-1-phenylpyrazole-4-sulfonamide Traditional Name: N-(3-bromobenzyl)-3,5-dimethyl-1-phenyl-pyrazole-4-sulfonamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NCC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NCC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H18BrN3O2S/c1-13-18(14(2)22(21-13)17-9-4-3-5-10-17)25(23,24)20-12-15-7-6-8-16(19)11-15/h3-11,20H,12H2,1-2H3