N-[2-(cyanomethylsulfanyl)phenyl]-2-[(3-fluorophenyl)methyl-methyl-amino]ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(3-fluorophenyl)methyl-methyl-amino]ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(3-fluorophenyl)methyl-methyl-amino]acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-[(3-fluorophenyl)methyl-methylamino]acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-[(3-fluorophenyl)methyl-methylamino]acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-[(3-fluorobenzyl)-methyl-amino]acetamide Formula: C18H18FN3OS MolecularWeight: 343.418423

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)CC(=O)NC2=CC=CC=C2SCC#N

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)CC(=O)NC2=CC=CC=C2SCC#N

InChI

InChI=1S/C18H18FN3OS/c1-22(12-14-5-4-6-15(19)11-14)13-18(23)21-16-7-2-3-8-17(16)24-10-9-20/h2-8,11H,10,12-13H2,1H3,(H,21,23)