4-[2-(benzotriazol-2-yl)ethanoyl]-1-cyclohexyl-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-[2-(benzotriazol-2-yl)ethanoyl]-1-cyclohexyl-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-[2-(benzotriazol-2-yl)acetyl]-1-cyclohexyl-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[2-(2-benzotriazolyl)-1-oxoethyl]-1-cyclohexyl-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-[2-(benzotriazol-2-yl)acetyl]-1-cyclohexyl-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-[2-(benzotriazol-2-yl)acetyl]-1-cyclohexyl-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H30N6O3 MolecularWeight: 462.5441

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CN3N=C4C=CC=CC4=N3)OCC5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CN3N=C4C=CC=CC4=N3)OCC5=CC=CC=N5

InChI

InChI=1S/C25H30N6O3/c32-24(17-31-27-22-11-4-5-12-23(22)28-31)29-14-21(34-18-19-8-6-7-13-26-19)15-30(25(33)16-29)20-9-2-1-3-10-20/h4-8,11-13,20-21H,1-3,9-10,14-18H2