1-cyclohexyl-4-(furan-3-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-(furan-3-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-(3-furylmethyl)-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-(3-furanylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(furan-3-ylmethyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-(3-furfuryl)-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)CC3=COC=C3)OCC4=CC=NC=C4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)CC3=COC=C3)OCC4=CC=NC=C4

InChI

InChI=1S/C22H29N3O3/c26-22-15-24(12-19-8-11-27-16-19)13-21(28-17-18-6-9-23-10-7-18)14-25(22)20-4-2-1-3-5-20/h6-11,16,20-21H,1-5,12-15,17H2