N-[2-[4-[[2-(4-chlorophenyl)ethylcarbamothioylamino]methyl]-2-methoxy-phenoxy]ethyl]ethanamide

Systemtic Name: N-[2-[4-[[2-(4-chlorophenyl)ethylcarbamothioylamino]methyl]-2-methoxy-phenoxy]ethyl]ethanamide Openeye Name: N-[2-[4-[[2-(4-chlorophenyl)ethylcarbamothioylamino]methyl]-2-methoxy-phenoxy]ethyl]acetamide CAS Name: N-[2-[4-[[[[2-(4-chlorophenyl)ethylamino]-sulfanylidenemethyl]amino]methyl]-2-methoxyphenoxy]ethyl]acetamide IUPAC Name: N-[2-[4-[[2-(4-chlorophenyl)ethylcarbamothioylamino]methyl]-2-methoxyphenoxy]ethyl]acetamide Traditional Name: N-[2-[4-[[2-(4-chlorophenyl)ethylthiocarbamoylamino]methyl]-2-methoxy-phenoxy]ethyl]acetamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCOC1=C(C=C(C=C1)CNC(=S)NCCC2=CC=C(C=C2)Cl)OC

Isomeric SMILES

CC(=O)NCCOC1=C(C=C(C=C1)CNC(=S)NCCC2=CC=C(C=C2)Cl)OC

InChI

InChI=1S/C21H26ClN3O3S/c1-15(26)23-11-12-28-19-8-5-17(13-20(19)27-2)14-25-21(29)24-10-9-16-3-6-18(22)7-4-16/h3-8,13H,9-12,14H2,1-2H3,(H,23,26)(H2,24,25,29)