1-(3-bromanyl-2-chloranyl-phenyl)-N-(cyanomethyl)-N-pentyl-methanesulfonamide

Systemtic Name: 1-(3-bromanyl-2-chloranyl-phenyl)-N-(cyanomethyl)-N-pentyl-methanesulfonamide Openeye Name: 1-(3-bromo-2-chloro-phenyl)-N-(cyanomethyl)-N-pentyl-methanesulfonamide CAS Name: 1-(3-bromo-2-chlorophenyl)-N-(cyanomethyl)-N-pentylmethanesulfonamide IUPAC Name: 1-(3-bromo-2-chlorophenyl)-N-(cyanomethyl)-N-pentylmethanesulfonamide Traditional Name: N-amyl-1-(3-bromo-2-chloro-phenyl)-N-(cyanomethyl)methanesulfonamide Formula: C14H18BrClN2O2S MolecularWeight: 393.72692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC#N)S(=O)(=O)CC1=C(C(=CC=C1)Br)Cl

Isomeric SMILES

CCCCCN(CC#N)S(=O)(=O)CC1=C(C(=CC=C1)Br)Cl

InChI

InChI=1S/C14H18BrClN2O2S/c1-2-3-4-9-18(10-8-17)21(19,20)11-12-6-5-7-13(15)14(12)16/h5-7H,2-4,9-11H2,1H3