4-[(5-ethyl-2-methyl-imidazol-1-yl)methyl]-2-fluoranyl-benzenecarbonitrile; N-methylmethanamine

Systemtic Name: 4-[(5-ethyl-2-methyl-imidazol-1-yl)methyl]-2-fluoranyl-benzenecarbonitrile; N-methylmethanamine Openeye Name: 4-[(5-ethyl-2-methyl-imidazol-1-yl)methyl]-2-fluoro-benzonitrile; N-methylmethanamine CAS Name: 4-[(5-ethyl-2-methyl-1-imidazolyl)methyl]-2-fluorobenzonitrile; N-methylmethanamine IUPAC Name: 4-[(5-ethyl-2-methylimidazol-1-yl)methyl]-2-fluorobenzonitrile; N-methylmethanamine Traditional Name: dimethylamine; 4-[(5-ethyl-2-methyl-imidazol-1-yl)methyl]-2-fluoro-benzonitrile Formula: C16H21FN4 MolecularWeight: 288.363143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N1CC2=CC(=C(C=C2)C#N)F)C.CNC

Isomeric SMILES

CCC1=CN=C(N1CC2=CC(=C(C=C2)C#N)F)C.CNC

InChI

InChI=1S/C14H14FN3.C2H7N/c1-3-13-8-17-10(2)18(13)9-11-4-5-12(7-16)14(15)6-11;1-3-2/h4-6,8H,3,9H2,1-2H3;3H,1-2H3