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

Systemtic Name: [2-[6-(1-tert-butyl-1,4-diazepan-2-yl)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Openeye Name: [2-[6-(1-tert-butyl-1,4-diazepan-2-yl)-3-pyridyl]-1H-benzimidazol-4-yl] carbamate CAS Name: carbamic acid [2-[6-(1-tert-butyl-1,4-diazepan-2-yl)-3-pyridinyl]-1H-benzimidazol-4-yl] ester IUPAC Name: [2-[6-(1-tert-butyl-1,4-diazepan-2-yl)pyridin-3-yl]-1H-benzimidazol-4-yl] carbamate Traditional Name: carbamic acid [2-[6-(1-tert-butyl-1,4-diazepan-2-yl)-3-pyridyl]-1H-benzimidazol-4-yl] ester Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CCCNCC1C2=NC=C(C=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

Isomeric SMILES

CC(C)(C)N1CCCNCC1C2=NC=C(C=C2)C3=NC4=C(N3)C=CC=C4OC(=O)N

InChI

InChI=1S/C22H28N6O2/c1-22(2,3)28-11-5-10-24-13-17(28)15-9-8-14(12-25-15)20-26-16-6-4-7-18(19(16)27-20)30-21(23)29/h4,6-9,12,17,24H,5,10-11,13H2,1-3H3,(H2,23,29)(H,26,27)