N-[1-(2-bromophenyl)ethyl]-2-(cyanomethylsulfanyl)ethanamide

Systemtic Name: N-[1-(2-bromophenyl)ethyl]-2-(cyanomethylsulfanyl)ethanamide Openeye Name: N-[1-(2-bromophenyl)ethyl]-2-(cyanomethylsulfanyl)acetamide CAS Name: N-[1-(2-bromophenyl)ethyl]-2-(cyanomethylthio)acetamide IUPAC Name: N-[1-(2-bromophenyl)ethyl]-2-(cyanomethylsulfanyl)acetamide Traditional Name: N-[1-(2-bromophenyl)ethyl]-2-(cyanomethylthio)acetamide Formula: C12H13BrN2OS MolecularWeight: 313.21342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC(=O)CSCC#N

Isomeric SMILES

CC(C1=CC=CC=C1Br)NC(=O)CSCC#N

InChI

InChI=1S/C12H13BrN2OS/c1-9(10-4-2-3-5-11(10)13)15-12(16)8-17-7-6-14/h2-5,9H,7-8H2,1H3,(H,15,16)