1-cyclohexyl-4-(2-indazol-1-ylethanoyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-(2-indazol-1-ylethanoyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-(2-indazol-1-ylacetyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[2-(1-indazolyl)-1-oxoethyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(2-indazol-1-ylacetyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-(2-indazol-1-ylacetyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CN3C4=CC=CC=C4C=N3)OCC5=CN=CC=C5

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)CN3C4=CC=CC=C4C=N3)OCC5=CN=CC=C5

InChI

InChI=1S/C26H31N5O3/c32-25(18-31-24-11-5-4-8-21(24)14-28-31)29-15-23(34-19-20-7-6-12-27-13-20)16-30(26(33)17-29)22-9-2-1-3-10-22/h4-8,11-14,22-23H,1-3,9-10,15-19H2