1-cyclohexyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CN2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=CC=N4

Isomeric SMILES

CC1=C(N=CN1)CN2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=CC=N4

InChI

InChI=1S/C22H31N5O2/c1-17-21(25-16-24-17)13-26-11-20(29-15-18-7-5-6-10-23-18)12-27(22(28)14-26)19-8-3-2-4-9-19/h5-7,10,16,19-20H,2-4,8-9,11-15H2,1H3,(H,24,25)