N-[6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridin-3-yl]pentane-1-sulfonamide

Systemtic Name: N-[6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridin-3-yl]pentane-1-sulfonamide Openeye Name: N-[6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]-3-pyridyl]pentane-1-sulfonamide CAS Name: N-[6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-3-pyridinyl]-1-pentanesulfonamide IUPAC Name: N-[6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridin-3-yl]pentane-1-sulfonamide Traditional Name: N-[6-[4-[2-(trifluoromethyl)benzoyl]piperazino]-3-pyridyl]pentane-1-sulfonamide Formula: C22H27F3N4O3S MolecularWeight: 484.53499

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCCCCS(=O)(=O)NC1=CN=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C22H27F3N4O3S/c1-2-3-6-15-33(31,32)27-17-9-10-20(26-16-17)28-11-13-29(14-12-28)21(30)18-7-4-5-8-19(18)22(23,24)25/h4-5,7-10,16,27H,2-3,6,11-15H2,1H3