1-(3-methylbutyl)-2-[(2-oxidanylidene-3-prop-1-en-2-yl-benzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile

Systemtic Name: 1-(3-methylbutyl)-2-[(2-oxidanylidene-3-prop-1-en-2-yl-benzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile Openeye Name: 1-isopentyl-2-[(3-isopropenyl-2-oxo-benzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile CAS Name: 1-(3-methylbutyl)-2-[[3-(1-methylethenyl)-2-oxo-1-benzimidazolyl]methyl]-5-benzimidazolecarbonitrile IUPAC Name: 1-(3-methylbutyl)-2-[(2-oxo-3-prop-1-en-2-ylbenzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile Traditional Name: 1-isoamyl-2-[(3-isopropenyl-2-keto-benzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(C=C(C=C2)C#N)N=C1CN3C4=CC=CC=C4N(C3=O)C(=C)C

Isomeric SMILES

CC(C)CCN1C2=C(C=C(C=C2)C#N)N=C1CN3C4=CC=CC=C4N(C3=O)C(=C)C

InChI

InChI=1S/C24H25N5O/c1-16(2)11-12-27-20-10-9-18(14-25)13-19(20)26-23(27)15-28-21-7-5-6-8-22(21)29(17(3)4)24(28)30/h5-10,13,16H,3,11-12,15H2,1-2,4H3