2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-N-[3-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-N-[3-(trifluoromethyl)phenyl]butanamide Openeye Name: 2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-N-[3-(trifluoromethyl)phenyl]butanamide CAS Name: 2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]-N-[3-(trifluoromethyl)phenyl]butanamide IUPAC Name: 2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-N-[3-(trifluoromethyl)phenyl]butanamide Traditional Name: 2-[[3-[(2-phenylacetyl)amino]phenyl]thio]-N-[3-(trifluoromethyl)phenyl]butyramide Formula: C25H23F3N2O2S MolecularWeight: 472.52253

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)C(F)(F)F)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H23F3N2O2S/c1-2-22(24(32)30-19-11-6-10-18(15-19)25(26,27)28)33-21-13-7-12-20(16-21)29-23(31)14-17-8-4-3-5-9-17/h3-13,15-16,22H,2,14H2,1H3,(H,29,31)(H,30,32)