3-[(4-chlorophenyl)methylsulfanyl]-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide CAS Name: 3-[(4-chlorophenyl)methylthio]-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-N-[2-(3,4-diethoxyphenyl)ethyl]propanamide Traditional Name: 3-[(4-chlorobenzyl)thio]-N-[2-(3,4-diethoxyphenyl)ethyl]propionamide Formula: C22H28ClNO3S MolecularWeight: 421.98062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CCSCC2=CC=C(C=C2)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CCSCC2=CC=C(C=C2)Cl)OCC

InChI

InChI=1S/C22H28ClNO3S/c1-3-26-20-10-7-17(15-21(20)27-4-2)11-13-24-22(25)12-14-28-16-18-5-8-19(23)9-6-18/h5-10,15H,3-4,11-14,16H2,1-2H3,(H,24,25)