1-cyclohexyl-6-(pyridin-2-ylmethoxy)-4-(quinolin-8-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-6-(pyridin-2-ylmethoxy)-4-(quinolin-8-ylmethyl)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-6-(2-pyridylmethoxy)-4-(8-quinolylmethyl)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-6-(2-pyridinylmethoxy)-4-(8-quinolinylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-6-(pyridin-2-ylmethoxy)-4-(quinolin-8-ylmethyl)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-6-(2-pyridylmethoxy)-4-(8-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=CC4=C3N=CC=C4)OCC5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)CC3=CC=CC4=C3N=CC=C4)OCC5=CC=CC=N5

InChI

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