2-[[2-(3-azanylpropyl)-5,6-dimethoxy-benzimidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2-(3-azanylpropyl)-5,6-dimethoxy-benzimidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[2-(3-aminopropyl)-5,6-dimethoxy-benzimidazol-1-yl]methyl]benzonitrile CAS Name: 2-[[2-(3-aminopropyl)-5,6-dimethoxy-1-benzimidazolyl]methyl]benzonitrile IUPAC Name: 2-[[2-(3-aminopropyl)-5,6-dimethoxybenzimidazol-1-yl]methyl]benzonitrile Traditional Name: 2-[[2-(3-aminopropyl)-5,6-dimethoxy-benzimidazol-1-yl]methyl]benzonitrile Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CC3=CC=CC=C3C#N)CCCN)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2CC3=CC=CC=C3C#N)CCCN)OC

InChI

InChI=1S/C20H22N4O2/c1-25-18-10-16-17(11-19(18)26-2)24(20(23-16)8-5-9-21)13-15-7-4-3-6-14(15)12-22/h3-4,6-7,10-11H,5,8-9,13,21H2,1-2H3