4-(2-indazol-1-ylethanoyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(2-indazol-1-ylethanoyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(2-indazol-1-ylacetyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[2-(1-indazolyl)-1-oxoethyl]-1-[(1-methyl-4-pyrazolyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(2-indazol-1-ylacetyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(2-indazol-1-ylacetyl)-1-[(1-methylpyrazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H27N7O3 MolecularWeight: 473.52698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CC(CN(CC2=O)C(=O)CN3C4=CC=CC=C4C=N3)OCC5=CC=NC=C5

Isomeric SMILES

CN1C=C(C=N1)CN2CC(CN(CC2=O)C(=O)CN3C4=CC=CC=C4C=N3)OCC5=CC=NC=C5

InChI

InChI=1S/C25H27N7O3/c1-29-12-20(10-27-29)13-30-14-22(35-18-19-6-8-26-9-7-19)15-31(16-24(30)33)25(34)17-32-23-5-3-2-4-21(23)11-28-32/h2-12,22H,13-18H2,1H3