N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]butane-1-sulfonamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]butane-1-sulfonamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]butane-1-sulfonamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-1-butanesulfonamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]butane-1-sulfonamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]butane-1-sulfonamide Formula: C14H18BrN3O2S MolecularWeight: 372.28062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CN(N=C1)CC2=CC=C(C=C2)Br

Isomeric SMILES

CCCCS(=O)(=O)NC1=CN(N=C1)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H18BrN3O2S/c1-2-3-8-21(19,20)17-14-9-16-18(11-14)10-12-4-6-13(15)7-5-12/h4-7,9,11,17H,2-3,8,10H2,1H3