N-[3,5-bis[[(2S)-2-methylpiperidin-1-yl]carbonyl]phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3,5-bis[[(2S)-2-methylpiperidin-1-yl]carbonyl]phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3,5-bis[(2S)-2-methylpiperidine-1-carbonyl]phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[3,5-bis[[(2S)-2-methyl-1-piperidinyl]-oxomethyl]phenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3,5-bis[(2S)-2-methylpiperidine-1-carbonyl]phenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[3,5-bis[(2S)-2-methylpiperidine-1-carbonyl]phenyl]-4-fluoro-benzenesulfonamide Formula: C26H32FN3O4S MolecularWeight: 501.613383

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=CC(=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)F)C(=O)N4CCCCC4C

Isomeric SMILES

C[C@H]1CCCCN1C(=O)C2=CC(=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)F)C(=O)N4CCCC[C@@H]4C

InChI

InChI=1S/C26H32FN3O4S/c1-18-7-3-5-13-29(18)25(31)20-15-21(26(32)30-14-6-4-8-19(30)2)17-23(16-20)28-35(33,34)24-11-9-22(27)10-12-24/h9-12,15-19,28H,3-8,13-14H2,1-2H3/t18-,19-/m0/s1