2-bromanyl-4-methyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 2-bromanyl-4-methyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 2-bromo-4-methyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide CAS Name: 2-bromo-4-methyl-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 2-bromo-4-methyl-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 2-bromo-4-methyl-N-[4-(pyrazol-1-ylmethyl)benzyl]benzenesulfonamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)CN3C=CC=N3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)CN3C=CC=N3)Br

InChI

InChI=1S/C18H18BrN3O2S/c1-14-3-8-18(17(19)11-14)25(23,24)21-12-15-4-6-16(7-5-15)13-22-10-2-9-20-22/h2-11,21H,12-13H2,1H3