2-bromanyl-N-(chloromethyl)-N-(2-ethyl-5-methylsulfanyl-phenyl)butanamide

Systemtic Name: 2-bromanyl-N-(chloromethyl)-N-(2-ethyl-5-methylsulfanyl-phenyl)butanamide Openeye Name: 2-bromo-N-(chloromethyl)-N-(2-ethyl-5-methylsulfanyl-phenyl)butanamide CAS Name: 2-bromo-N-(chloromethyl)-N-[2-ethyl-5-(methylthio)phenyl]butanamide IUPAC Name: 2-bromo-N-(chloromethyl)-N-(2-ethyl-5-methylsulfanylphenyl)butanamide Traditional Name: 2-bromo-N-(chloromethyl)-N-[2-ethyl-5-(methylthio)phenyl]butyramide Formula: C14H19BrClNOS MolecularWeight: 364.72876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)SC)N(CCl)C(=O)C(CC)Br

Isomeric SMILES

CCC1=C(C=C(C=C1)SC)N(CCl)C(=O)C(CC)Br

InChI

InChI=1S/C14H19BrClNOS/c1-4-10-6-7-11(19-3)8-13(10)17(9-16)14(18)12(15)5-2/h6-8,12H,4-5,9H2,1-3H3