1-cyclohexyl-4-(4-imidazol-1-ylphenyl)carbonyl-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-(4-imidazol-1-ylphenyl)carbonyl-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-(4-imidazol-1-ylbenzoyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[[4-(1-imidazolyl)phenyl]-oxomethyl]-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(4-imidazol-1-ylbenzoyl)-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-(4-imidazol-1-ylbenzoyl)-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CC=C(C=C3)N4C=CN=C4)OCC5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CC=C(C=C3)N4C=CN=C4)OCC5=CC=CC=N5

InChI

InChI=1S/C27H31N5O3/c33-26-18-31(27(34)21-9-11-23(12-10-21)30-15-14-28-20-30)16-25(35-19-22-6-4-5-13-29-22)17-32(26)24-7-2-1-3-8-24/h4-6,9-15,20,24-25H,1-3,7-8,16-19H2