5-[3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-2-oxidanylidene-benzimidazol-1-yl]pentanenitrile

Systemtic Name: 5-[3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-2-oxidanylidene-benzimidazol-1-yl]pentanenitrile Openeye Name: 5-[3-[(1-isopentylbenzimidazol-2-yl)methyl]-2-oxo-benzimidazol-1-yl]pentanenitrile CAS Name: 5-[3-[[1-(3-methylbutyl)-2-benzimidazolyl]methyl]-2-oxo-1-benzimidazolyl]pentanenitrile IUPAC Name: 5-[3-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-2-oxobenzimidazol-1-yl]pentanenitrile Traditional Name: 5-[3-[(1-isoamylbenzimidazol-2-yl)methyl]-2-keto-benzimidazol-1-yl]valeronitrile 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)CCCCC#N

Isomeric SMILES

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

InChI

InChI=1S/C25H29N5O/c1-19(2)14-17-28-21-11-5-4-10-20(21)27-24(28)18-30-23-13-7-6-12-22(23)29(25(30)31)16-9-3-8-15-26/h4-7,10-13,19H,3,8-9,14,16-18H2,1-2H3