4-[2,5-bis(fluoranyl)phenyl]carbonyl-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-[2,5-bis(fluoranyl)phenyl]carbonyl-1-cyclohexyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-(2,5-difluorobenzoyl)-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[(2,5-difluorophenyl)-oxomethyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(2,5-difluorobenzoyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-(2,5-difluorobenzoyl)-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C24H27F2N3O3 MolecularWeight: 443.486286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27F2N3O3/c25-18-6-7-22(26)21(12-18)24(31)28-13-20(32-16-17-8-10-27-11-9-17)14-29(23(30)15-28)19-4-2-1-3-5-19/h6-12,19-20H,1-5,13-16H2