2-[2-(3-chloranylphenoxy)ethylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[2-(3-chloranylphenoxy)ethylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[2-(3-chlorophenoxy)ethylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[2-(3-chlorophenoxy)ethylthio]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[2-(3-chlorophenoxy)ethylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[2-(3-chlorophenoxy)ethylthio]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C20H23ClN2O4S2 MolecularWeight: 454.99062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCCOC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCCOC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O4S2/c21-16-5-3-7-18(13-16)27-11-12-28-15-20(24)22-17-6-4-8-19(14-17)29(25,26)23-9-1-2-10-23/h3-8,13-14H,1-2,9-12,15H2,(H,22,24)