[2-[6-(4-propyl-1,4-diazepan-1-yl)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate

Systemtic Name: [2-[6-(4-propyl-1,4-diazepan-1-yl)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Openeye Name: [2-[6-(4-propyl-1,4-diazepan-1-yl)-3-pyridyl]-1H-benzimidazol-4-yl] carbamate CAS Name: carbamic acid [2-[6-(4-propyl-1,4-diazepan-1-yl)-3-pyridinyl]-1H-benzimidazol-4-yl] ester IUPAC Name: [2-[6-(4-propyl-1,4-diazepan-1-yl)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Traditional Name: carbamic acid [2-[6-(4-propyl-1,4-diazepan-1-yl)-3-pyridyl]-1H-benzimidazol-4-yl] ester Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCN(CC1)C2=NC=C(C=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

Isomeric SMILES

CCCN1CCCN(CC1)C2=NC=C(C=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

InChI

InChI=1S/C21H26N6O2/c1-2-9-26-10-4-11-27(13-12-26)18-8-7-15(14-23-18)20-24-16-5-3-6-17(19(16)25-20)29-21(22)28/h3,5-8,14H,2,4,9-13H2,1H3,(H2,22,28)(H,24,25)