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

Systemtic Name: 1-cyclohexyl-6-(pyridin-3-ylmethoxy)-4-(quinolin-4-ylmethyl)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-6-(3-pyridylmethoxy)-4-(4-quinolylmethyl)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-6-(3-pyridinylmethoxy)-4-(4-quinolinylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-6-(pyridin-3-ylmethoxy)-4-(quinolin-4-ylmethyl)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-6-(3-pyridylmethoxy)-4-(4-quinolylmethyl)-1,4-diazepan-2-one Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)CC3=CC=NC4=CC=CC=C34)OCC5=CN=CC=C5

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)CC3=CC=NC4=CC=CC=C34)OCC5=CN=CC=C5

InChI

InChI=1S/C27H32N4O2/c32-27-19-30(16-22-12-14-29-26-11-5-4-10-25(22)26)17-24(33-20-21-7-6-13-28-15-21)18-31(27)23-8-2-1-3-9-23/h4-7,10-15,23-24H,1-3,8-9,16-20H2