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

Systemtic Name: N-[(3-bromophenyl)methyl]-1,3-dimethyl-pyrazole-4-sulfonamide Openeye Name: N-[(3-bromophenyl)methyl]-1,3-dimethyl-pyrazole-4-sulfonamide CAS Name: N-[(3-bromophenyl)methyl]-1,3-dimethyl-4-pyrazolesulfonamide IUPAC Name: N-[(3-bromophenyl)methyl]-1,3-dimethylpyrazole-4-sulfonamide Traditional Name: N-(3-bromobenzyl)-1,3-dimethyl-pyrazole-4-sulfonamide Formula: C12H14BrN3O2S MolecularWeight: 344.22746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1S(=O)(=O)NCC2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=NN(C=C1S(=O)(=O)NCC2=CC(=CC=C2)Br)C

InChI

InChI=1S/C12H14BrN3O2S/c1-9-12(8-16(2)15-9)19(17,18)14-7-10-4-3-5-11(13)6-10/h3-6,8,14H,7H2,1-2H3