2-[1-(3-methylbutyl)-2-[(2-oxidanylidene-3-propan-2-yl-benzimidazol-1-yl)methyl]benzimidazol-4-yl]ethanenitrile

Systemtic Name: 2-[1-(3-methylbutyl)-2-[(2-oxidanylidene-3-propan-2-yl-benzimidazol-1-yl)methyl]benzimidazol-4-yl]ethanenitrile Openeye Name: 2-[1-isopentyl-2-[(3-isopropyl-2-oxo-benzimidazol-1-yl)methyl]benzimidazol-4-yl]acetonitrile CAS Name: 2-[1-(3-methylbutyl)-2-[(2-oxo-3-propan-2-yl-1-benzimidazolyl)methyl]-4-benzimidazolyl]acetonitrile IUPAC Name: 2-[1-(3-methylbutyl)-2-[(2-oxo-3-propan-2-ylbenzimidazol-1-yl)methyl]benzimidazol-4-yl]acetonitrile Traditional Name: 2-[1-isoamyl-2-[(3-isopropyl-2-keto-benzimidazol-1-yl)methyl]benzimidazol-4-yl]acetonitrile Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC(=C2N=C1CN3C4=CC=CC=C4N(C3=O)C(C)C)CC#N

Isomeric SMILES

CC(C)CCN1C2=CC=CC(=C2N=C1CN3C4=CC=CC=C4N(C3=O)C(C)C)CC#N

InChI

InChI=1S/C25H29N5O/c1-17(2)13-15-28-22-11-7-8-19(12-14-26)24(22)27-23(28)16-29-20-9-5-6-10-21(20)30(18(3)4)25(29)31/h5-11,17-18H,12-13,15-16H2,1-4H3