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

Systemtic Name: 3-(3-methylbutyl)-2-[(2-oxidanylidene-3-propan-2-yl-benzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile Openeye Name: 3-isopentyl-2-[(3-isopropyl-2-oxo-benzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile CAS Name: 3-(3-methylbutyl)-2-[(2-oxo-3-propan-2-yl-1-benzimidazolyl)methyl]-5-benzimidazolecarbonitrile IUPAC Name: 3-(3-methylbutyl)-2-[(2-oxo-3-propan-2-ylbenzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile Traditional Name: 3-isoamyl-2-[(3-isopropyl-2-keto-benzimidazol-1-yl)methyl]benzimidazole-5-carbonitrile Formula: C24H27N5O MolecularWeight: 401.50408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N5O/c1-16(2)11-12-27-22-13-18(14-25)9-10-19(22)26-23(27)15-28-20-7-5-6-8-21(20)29(17(3)4)24(28)30/h5-10,13,16-17H,11-12,15H2,1-4H3