1-cyclohexyl-4-(1H-imidazol-5-ylcarbonyl)-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-(1H-imidazol-5-ylcarbonyl)-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-cyclohexyl-4-(1H-imidazole-5-carbonyl)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[1H-imidazol-5-yl(oxo)methyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(1H-imidazole-5-carbonyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-cyclohexyl-4-(1H-imidazole-5-carbonyl)-1,4-diazepan-2-one Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CN=CN3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CN=CN3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H28N4O3/c27-21-14-25(22(28)20-11-23-16-24-20)12-19(29-15-17-7-3-1-4-8-17)13-26(21)18-9-5-2-6-10-18/h1,3-4,7-8,11,16,18-19H,2,5-6,9-10,12-15H2,(H,23,24)