2-[[5-cyano-1-(3-methylbutyl)benzimidazol-2-yl]methyl]benzotriazole-5-carbonitrile

Systemtic Name: 2-[[5-cyano-1-(3-methylbutyl)benzimidazol-2-yl]methyl]benzotriazole-5-carbonitrile Openeye Name: 2-[(5-cyano-1-isopentyl-benzimidazol-2-yl)methyl]benzotriazole-5-carbonitrile CAS Name: 2-[[5-cyano-1-(3-methylbutyl)-2-benzimidazolyl]methyl]-5-benzotriazolecarbonitrile IUPAC Name: 2-[[5-cyano-1-(3-methylbutyl)benzimidazol-2-yl]methyl]benzotriazole-5-carbonitrile Traditional Name: 2-[(5-cyano-1-isoamyl-benzimidazol-2-yl)methyl]benzotriazole-5-carbonitrile Formula: C21H19N7 MolecularWeight: 369.42246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(C=C(C=C2)C#N)N=C1CN3N=C4C=CC(=CC4=N3)C#N

Isomeric SMILES

CC(C)CCN1C2=C(C=C(C=C2)C#N)N=C1CN3N=C4C=CC(=CC4=N3)C#N

InChI

InChI=1S/C21H19N7/c1-14(2)7-8-27-20-6-4-16(12-23)10-19(20)24-21(27)13-28-25-17-5-3-15(11-22)9-18(17)26-28/h3-6,9-10,14H,7-8,13H2,1-2H3