3-[[1-(3-azanylidene-3-azido-propyl)benzimidazol-2-yl]methyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[[1-(3-azanylidene-3-azido-propyl)benzimidazol-2-yl]methyl]-1H-benzimidazol-2-one Openeye Name: 3-[2-[(2-oxo-3H-benzimidazol-1-yl)methyl]benzimidazol-1-yl]propanimidoyl azide CAS Name: 3-[[1-(3-azido-3-iminopropyl)-2-benzimidazolyl]methyl]-1H-benzimidazol-2-one IUPAC Name: 3-[2-[(2-oxo-3H-benzimidazol-1-yl)methyl]benzimidazol-1-yl]propanimidoyl azide Traditional Name: 3-[[1-(3-azido-3-imino-propyl)benzimidazol-2-yl]methyl]-1H-benzimidazol-2-one Formula: C18H16N8O MolecularWeight: 360.37264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CC3=NC4=CC=CC=C4N3CCC(=N)N=[N+]=[N-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CC3=NC4=CC=CC=C4N3CCC(=N)N=[N+]=[N-]

InChI

InChI=1S/C18H16N8O/c19-16(23-24-20)9-10-25-14-7-3-1-5-12(14)21-17(25)11-26-15-8-4-2-6-13(15)22-18(26)27/h1-8,19H,9-11H2,(H,22,27)