N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(4-chlorophenyl)methylsulfanyl]propanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(4-chlorophenyl)methylsulfanyl]propanamide Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-(1,1-dioxothiolan-3-yl)propanamide CAS Name: 2-[(4-chlorophenyl)methylthio]-N-(1,1-dioxo-3-thiolanyl)propanamide IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-(1,1-dioxothiolan-3-yl)propanamide Traditional Name: 2-[(4-chlorobenzyl)thio]-N-(1,1-diketothiolan-3-yl)propionamide Formula: C14H18ClNO3S2 MolecularWeight: 347.88062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCS(=O)(=O)C1)SCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)NC1CCS(=O)(=O)C1)SCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H18ClNO3S2/c1-10(20-8-11-2-4-12(15)5-3-11)14(17)16-13-6-7-21(18,19)9-13/h2-5,10,13H,6-9H2,1H3,(H,16,17)