2-[cyanomethyl-[3-fluoranyl-2-[1-(methylamino)ethyl]phenyl]amino]ethanenitrile

Systemtic Name: 2-[cyanomethyl-[3-fluoranyl-2-[1-(methylamino)ethyl]phenyl]amino]ethanenitrile Openeye Name: 2-[N-(cyanomethyl)-3-fluoro-2-[1-(methylamino)ethyl]anilino]acetonitrile CAS Name: 2-[N-(cyanomethyl)-3-fluoro-2-[1-(methylamino)ethyl]anilino]acetonitrile IUPAC Name: 2-[N-(cyanomethyl)-3-fluoro-2-[1-(methylamino)ethyl]anilino]acetonitrile Traditional Name: 2-[N-(cyanomethyl)-3-fluoro-2-[1-(methylamino)ethyl]anilino]acetonitrile Formula: C13H15FN4 MolecularWeight: 246.283403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC=C1F)N(CC#N)CC#N)NC

Isomeric SMILES

CC(C1=C(C=CC=C1F)N(CC#N)CC#N)NC

InChI

InChI=1S/C13H15FN4/c1-10(17-2)13-11(14)4-3-5-12(13)18(8-6-15)9-7-16/h3-5,10,17H,8-9H2,1-2H3