2-[6-(4-phenyl-1,4-diazepan-1-yl)pyridin-3-yl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[6-(4-phenyl-1,4-diazepan-1-yl)pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[6-(4-phenyl-1,4-diazepan-1-yl)-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[6-(4-phenyl-1,4-diazepan-1-yl)-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[6-(4-phenyl-1,4-diazepan-1-yl)pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[6-(4-phenyl-1,4-diazepan-1-yl)-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C24H24N6O MolecularWeight: 412.48696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN(C1)C2=NC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C24H24N6O/c25-23(31)19-8-4-9-20-22(19)28-24(27-20)17-10-11-21(26-16-17)30-13-5-12-29(14-15-30)18-6-2-1-3-7-18/h1-4,6-11,16H,5,12-15H2,(H2,25,31)(H,27,28)