N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide

Systemtic Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide Openeye Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide CAS Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(3,4-dimethylphenyl)thio]propanamide IUPAC Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-(3,4-dimethylphenyl)sulfanylpropanamide Traditional Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(3,4-dimethylphenyl)thio]propionamide Formula: C20H21F3N2O2S MolecularWeight: 410.45315

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=C(C=C(C=C2)NC(=O)C)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=C(C=C(C=C2)NC(=O)C)C(F)(F)F)C

InChI

InChI=1S/C20H21F3N2O2S/c1-12-4-6-16(10-13(12)2)28-9-8-19(27)25-18-7-5-15(24-14(3)26)11-17(18)20(21,22)23/h4-7,10-11H,8-9H2,1-3H3,(H,24,26)(H,25,27)