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

Systemtic Name: 2-[6-(4-butyl-1,4-diazepan-1-yl)pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[6-(4-butyl-1,4-diazepan-1-yl)-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[6-(4-butyl-1,4-diazepan-1-yl)-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[6-(4-butyl-1,4-diazepan-1-yl)pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[6-(4-butyl-1,4-diazepan-1-yl)-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCN(CC1)C2=NC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

Isomeric SMILES

CCCCN1CCCN(CC1)C2=NC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

InChI

InChI=1S/C22H28N6O/c1-2-3-10-27-11-5-12-28(14-13-27)19-9-8-16(15-24-19)22-25-18-7-4-6-17(21(23)29)20(18)26-22/h4,6-9,15H,2-3,5,10-14H2,1H3,(H2,23,29)(H,25,26)