2-[2-[(4-chlorophenyl)methylsulfanyl]ethanoyl-propyl-amino]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[2-[(4-chlorophenyl)methylsulfanyl]ethanoyl-propyl-amino]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]-propyl-amino]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[[2-[(4-chlorophenyl)methylthio]-1-oxoethyl]-propylamino]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]-propylamino]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[[2-[(4-chlorobenzyl)thio]acetyl]-propyl-amino]-N-(2-methoxyphenyl)acetamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1OC)C(=O)CSCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1OC)C(=O)CSCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H25ClN2O3S/c1-3-12-24(13-20(25)23-18-6-4-5-7-19(18)27-2)21(26)15-28-14-16-8-10-17(22)11-9-16/h4-11H,3,12-15H2,1-2H3,(H,23,25)