2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[3-(1-piperidyl)quinoxalin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[3-(1-piperidinyl)-2-quinoxalinyl]thio]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(3-piperidin-1-ylquinoxalin-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(3-piperidinoquinoxalin-2-yl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C22H21F3N4OS MolecularWeight: 446.48855

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C2=NC3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H21F3N4OS/c23-22(24,25)15-7-6-8-16(13-15)26-19(30)14-31-21-20(29-11-4-1-5-12-29)27-17-9-2-3-10-18(17)28-21/h2-3,6-10,13H,1,4-5,11-12,14H2,(H,26,30)