1-(2-azanylidene-2-azido-ethyl)-3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]benzimidazol-2-one

Systemtic Name: 1-(2-azanylidene-2-azido-ethyl)-3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]benzimidazol-2-one Openeye Name: 2-[3-[(1-isopentylbenzimidazol-2-yl)methyl]-2-oxo-benzimidazol-1-yl]acetimidoyl azide CAS Name: 1-(2-azido-2-iminoethyl)-3-[[1-(3-methylbutyl)-2-benzimidazolyl]methyl]-2-benzimidazolone IUPAC Name: 2-[3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-2-oxobenzimidazol-1-yl]ethanimidoyl azide Traditional Name: 1-(2-azido-2-imino-ethyl)-3-[(1-isoamylbenzimidazol-2-yl)methyl]benzimidazol-2-one Formula: C22H24N8O MolecularWeight: 416.47896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4N(C3=O)CC(=N)N=[N+]=[N-]

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2N=C1CN3C4=CC=CC=C4N(C3=O)CC(=N)N=[N+]=[N-]

InChI

InChI=1S/C22H24N8O/c1-15(2)11-12-28-17-8-4-3-7-16(17)25-21(28)14-30-19-10-6-5-9-18(19)29(22(30)31)13-20(23)26-27-24/h3-10,15,23H,11-14H2,1-2H3