2-(4-tert-butylphenoxy)-N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]propanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]propanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]propanamide CAS Name: 2-(4-tert-butylphenoxy)-N-[2-[(3-chlorophenyl)methylthio]ethyl]propanamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]propanamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[2-[(3-chlorobenzyl)thio]ethyl]propionamide Formula: C22H28ClNO2S MolecularWeight: 405.98122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCSCC1=CC(=CC=C1)Cl)OC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C(=O)NCCSCC1=CC(=CC=C1)Cl)OC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H28ClNO2S/c1-16(26-20-10-8-18(9-11-20)22(2,3)4)21(25)24-12-13-27-15-17-6-5-7-19(23)14-17/h5-11,14,16H,12-13,15H2,1-4H3,(H,24,25)