1-(3-chloranyl-2-fluoranyl-phenyl)-N-(cyanomethyl)-N-(2-methylsulfanylpropyl)methanesulfonamide

Systemtic Name: 1-(3-chloranyl-2-fluoranyl-phenyl)-N-(cyanomethyl)-N-(2-methylsulfanylpropyl)methanesulfonamide Openeye Name: 1-(3-chloro-2-fluoro-phenyl)-N-(cyanomethyl)-N-(2-methylsulfanylpropyl)methanesulfonamide CAS Name: 1-(3-chloro-2-fluorophenyl)-N-(cyanomethyl)-N-[2-(methylthio)propyl]methanesulfonamide IUPAC Name: 1-(3-chloro-2-fluorophenyl)-N-(cyanomethyl)-N-(2-methylsulfanylpropyl)methanesulfonamide Traditional Name: 1-(3-chloro-2-fluoro-phenyl)-N-(cyanomethyl)-N-[2-(methylthio)propyl]methanesulfonamide Formula: C13H16ClFN2O2S2 MolecularWeight: 350.859743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC#N)S(=O)(=O)CC1=C(C(=CC=C1)Cl)F)SC

Isomeric SMILES

CC(CN(CC#N)S(=O)(=O)CC1=C(C(=CC=C1)Cl)F)SC

InChI

InChI=1S/C13H16ClFN2O2S2/c1-10(20-2)8-17(7-6-16)21(18,19)9-11-4-3-5-12(14)13(11)15/h3-5,10H,7-9H2,1-2H3