4-chloranyl-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide Openeye Name: 4-chloro-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide CAS Name: 4-chloro-N-[2-ethyl-1-(2-phenyl-3-pyrazolyl)butyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide Traditional Name: 4-chloro-N-[2-ethyl-1-(2-phenylpyrazol-3-yl)butyl]benzenesulfonamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C1=CC=NN1C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(CC)C(C1=CC=NN1C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

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