4-chloranyl-N-[1-(4,5-diethyl-1H-pyrazol-3-yl)-2-phenyl-ethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-(4,5-diethyl-1H-pyrazol-3-yl)-2-phenyl-ethyl]benzenesulfonamide Openeye Name: 4-chloro-N-[1-(4,5-diethyl-1H-pyrazol-3-yl)-2-phenyl-ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[1-(4,5-diethyl-1H-pyrazol-3-yl)-2-phenylethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-(4,5-diethyl-1H-pyrazol-3-yl)-2-phenylethyl]benzenesulfonamide Traditional Name: 4-chloro-N-[1-(4,5-diethyl-1H-pyrazol-3-yl)-2-phenyl-ethyl]benzenesulfonamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NN=C1C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)CC

Isomeric SMILES

CCC1=C(NN=C1C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)CC

InChI

InChI=1S/C21H24ClN3O2S/c1-3-18-19(4-2)23-24-21(18)20(14-15-8-6-5-7-9-15)25-28(26,27)17-12-10-16(22)11-13-17/h5-13,20,25H,3-4,14H2,1-2H3,(H,23,24)