2-(4-tert-butylphenoxy)-N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]propanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]propanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]propanamide CAS Name: 2-(4-tert-butylphenoxy)-N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]propanamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]propanamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]propionamide Formula: C22H27ClFNO2S MolecularWeight: 423.971683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCSCC1=C(C=CC=C1Cl)F)OC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C(=O)NCCSCC1=C(C=CC=C1Cl)F)OC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H27ClFNO2S/c1-15(27-17-10-8-16(9-11-17)22(2,3)4)21(26)25-12-13-28-14-18-19(23)6-5-7-20(18)24/h5-11,15H,12-14H2,1-4H3,(H,25,26)