(2R)-2-acetamido-N-(3-butoxypropyl)-3-[3-(trifluoromethyl)phenyl]sulfanyl-propanamide

Systemtic Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-[3-(trifluoromethyl)phenyl]sulfanyl-propanamide Openeye Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-[3-(trifluoromethyl)phenyl]sulfanyl-propanamide CAS Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-[[3-(trifluoromethyl)phenyl]thio]propanamide IUPAC Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-[3-(trifluoromethyl)phenyl]sulfanylpropanamide Traditional Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-[[3-(trifluoromethyl)phenyl]thio]propionamide Formula: C19H27F3N2O3S MolecularWeight: 420.48949

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCNC(=O)C(CSC1=CC=CC(=C1)C(F)(F)F)NC(=O)C

Isomeric SMILES

CCCCOCCCNC(=O)[C@H](CSC1=CC=CC(=C1)C(F)(F)F)NC(=O)C

InChI

InChI=1S/C19H27F3N2O3S/c1-3-4-10-27-11-6-9-23-18(26)17(24-14(2)25)13-28-16-8-5-7-15(12-16)19(20,21)22/h5,7-8,12,17H,3-4,6,9-11,13H2,1-2H3,(H,23,26)(H,24,25)/t17-/m0/s1