4-butan-2-yl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzenesulfonamide

Systemtic Name: 4-butan-2-yl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzenesulfonamide Openeye Name: N-[3-(2-pyrazol-1-ylethoxy)phenyl]-4-sec-butyl-benzenesulfonamide CAS Name: 4-butan-2-yl-N-[3-[2-(1-pyrazolyl)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 4-butan-2-yl-N-[3-(2-pyrazol-1-ylethoxy)phenyl]benzenesulfonamide Traditional Name: N-[3-(2-pyrazol-1-ylethoxy)phenyl]-4-sec-butyl-benzenesulfonamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)OCCN3C=CC=N3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)OCCN3C=CC=N3

InChI

InChI=1S/C21H25N3O3S/c1-3-17(2)18-8-10-21(11-9-18)28(25,26)23-19-6-4-7-20(16-19)27-15-14-24-13-5-12-22-24/h4-13,16-17,23H,3,14-15H2,1-2H3