3-[1-[(1-ethyl-5-isocyano-benzimidazol-2-yl)methyl]imidazol-2-yl]benzenecarbonitrile

Systemtic Name: 3-[1-[(1-ethyl-5-isocyano-benzimidazol-2-yl)methyl]imidazol-2-yl]benzenecarbonitrile Openeye Name: 3-[1-[(1-ethyl-5-isocyano-benzimidazol-2-yl)methyl]imidazol-2-yl]benzonitrile CAS Name: 3-[1-[(1-ethyl-5-isocyano-2-benzimidazolyl)methyl]-2-imidazolyl]benzonitrile IUPAC Name: 3-[1-[(1-ethyl-5-isocyanobenzimidazol-2-yl)methyl]imidazol-2-yl]benzonitrile Traditional Name: 3-[1-[(1-ethyl-5-isocyano-benzimidazol-2-yl)methyl]imidazol-2-yl]benzonitrile Formula: C21H16N6 MolecularWeight: 352.39194

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+]#[C-])N=C1CN3C=CN=C3C4=CC=CC(=C4)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+]#[C-])N=C1CN3C=CN=C3C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H16N6/c1-3-27-19-8-7-17(23-2)12-18(19)25-20(27)14-26-10-9-24-21(26)16-6-4-5-15(11-16)13-22/h4-12H,3,14H2,1H3