3-[1-(6-cyano-1H-benzimidazol-2-yl)-4-methyl-pentyl]benzotriazole-5-carbonitrile

Systemtic Name: 3-[1-(6-cyano-1H-benzimidazol-2-yl)-4-methyl-pentyl]benzotriazole-5-carbonitrile Openeye Name: 3-[1-(6-cyano-1H-benzimidazol-2-yl)-4-methyl-pentyl]benzotriazole-5-carbonitrile CAS Name: 3-[1-(6-cyano-1H-benzimidazol-2-yl)-4-methylpentyl]-5-benzotriazolecarbonitrile IUPAC Name: 3-[1-(6-cyano-1H-benzimidazol-2-yl)-4-methylpentyl]benzotriazole-5-carbonitrile Traditional Name: 3-[1-(6-cyano-1H-benzimidazol-2-yl)-4-methyl-pentyl]benzotriazole-5-carbonitrile Formula: C21H19N7 MolecularWeight: 369.42246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C1=NC2=C(N1)C=C(C=C2)C#N)N3C4=C(C=CC(=C4)C#N)N=N3

Isomeric SMILES

CC(C)CCC(C1=NC2=C(N1)C=C(C=C2)C#N)N3C4=C(C=CC(=C4)C#N)N=N3

InChI

InChI=1S/C21H19N7/c1-13(2)3-8-19(21-24-16-6-4-14(11-22)9-18(16)25-21)28-20-10-15(12-23)5-7-17(20)26-27-28/h4-7,9-10,13,19H,3,8H2,1-2H3,(H,24,25)