2-propyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]pentanamide

Systemtic Name: 2-propyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]pentanamide Openeye Name: 2-propyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]pentanamide CAS Name: 2-propyl-N-[2-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]ethyl]pentanamide IUPAC Name: 2-propyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylethyl]pentanamide Traditional Name: 2-propyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazino]sulfonylethyl]valeramide Formula: C21H32F3N3O3S MolecularWeight: 463.55729

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCC(CCC)C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C21H32F3N3O3S/c1-3-6-17(7-4-2)20(28)25-10-15-31(29,30)27-13-11-26(12-14-27)19-9-5-8-18(16-19)21(22,23)24/h5,8-9,16-17H,3-4,6-7,10-15H2,1-2H3,(H,25,28)