3-[2-(benzotriazol-1-ylmethyl)benzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-(benzotriazol-1-ylmethyl)benzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-(benzotriazol-1-ylmethyl)benzimidazol-1-yl]propanenitrile CAS Name: 3-[2-(1-benzotriazolylmethyl)-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-(benzotriazol-1-ylmethyl)benzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-(benzotriazol-1-ylmethyl)benzimidazol-1-yl]propionitrile Formula: C17H14N6 MolecularWeight: 302.33326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC#N)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC#N)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H14N6/c18-10-5-11-22-15-8-3-1-6-13(15)19-17(22)12-23-16-9-4-2-7-14(16)20-21-23/h1-4,6-9H,5,11-12H2