N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-fluoranyl-phenyl]-4-phenyl-benzenesulfonamide

Systemtic Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-fluoranyl-phenyl]-4-phenyl-benzenesulfonamide Openeye Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-fluoro-phenyl]-4-phenyl-benzenesulfonamide CAS Name: N-[5-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-2-fluorophenyl]-4-phenylbenzenesulfonamide IUPAC Name: N-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-fluorophenyl]-4-phenylbenzenesulfonamide Traditional Name: N-[5-[(3R,5S)-3,5-dimethylpiperazino]-2-fluoro-phenyl]-4-phenyl-benzenesulfonamide Formula: C24H26FN3O2S MolecularWeight: 439.545543

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)C2=CC(=C(C=C2)F)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)C2=CC(=C(C=C2)F)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26FN3O2S/c1-17-15-28(16-18(2)26-17)21-10-13-23(25)24(14-21)27-31(29,30)22-11-8-20(9-12-22)19-6-4-3-5-7-19/h3-14,17-18,26-27H,15-16H2,1-2H3/t17-,18+