N-(4-bromanyl-1H-pyrazol-5-yl)-4-butoxy-benzenesulfonamide

Systemtic Name: N-(4-bromanyl-1H-pyrazol-5-yl)-4-butoxy-benzenesulfonamide Openeye Name: N-(4-bromo-1H-pyrazol-5-yl)-4-butoxy-benzenesulfonamide CAS Name: N-(4-bromo-1H-pyrazol-5-yl)-4-butoxybenzenesulfonamide IUPAC Name: N-(4-bromo-1H-pyrazol-5-yl)-4-butoxybenzenesulfonamide Traditional Name: N-(4-bromo-1H-pyrazol-5-yl)-4-butoxy-benzenesulfonamide Formula: C13H16BrN3O3S MolecularWeight: 374.25344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=NN2)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=NN2)Br

InChI

InChI=1S/C13H16BrN3O3S/c1-2-3-8-20-10-4-6-11(7-5-10)21(18,19)17-13-12(14)9-15-16-13/h4-7,9H,2-3,8H2,1H3,(H2,15,16,17)