N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-butyl-benzenesulfonamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-butyl-benzenesulfonamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-butyl-benzenesulfonamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-4-butylbenzenesulfonamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-butylbenzenesulfonamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]-4-butyl-benzenesulfonamide Formula: C20H22BrN3O2S MolecularWeight: 448.37658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O2S/c1-2-3-4-16-7-11-20(12-8-16)27(25,26)23-19-13-22-24(15-19)14-17-5-9-18(21)10-6-17/h5-13,15,23H,2-4,14H2,1H3