1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-3-ylmethoxy)-4-[(1-pyridin-3-ylpyrrol-2-yl)methyl]-1,4-diazepan-2-one

Systemtic Name: 1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-3-ylmethoxy)-4-[(1-pyridin-3-ylpyrrol-2-yl)methyl]-1,4-diazepan-2-one Openeye Name: 1-[(1-methylpyrazol-4-yl)methyl]-6-(3-pyridylmethoxy)-4-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-1,4-diazepan-2-one CAS Name: 1-[(1-methyl-4-pyrazolyl)methyl]-6-(3-pyridinylmethoxy)-4-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]-1,4-diazepan-2-one IUPAC Name: 1-[(1-methylpyrazol-4-yl)methyl]-6-(pyridin-3-ylmethoxy)-4-[(1-pyridin-3-ylpyrrol-2-yl)methyl]-1,4-diazepan-2-one Traditional Name: 1-[(1-methylpyrazol-4-yl)methyl]-6-(3-pyridylmethoxy)-4-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-1,4-diazepan-2-one Formula: C26H29N7O2 MolecularWeight: 471.55416

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN2CC(CN(CC2=O)CC3=CC=CN3C4=CN=CC=C4)OCC5=CN=CC=C5

Isomeric SMILES

CN1C=C(C=N1)CN2CC(CN(CC2=O)CC3=CC=CN3C4=CN=CC=C4)OCC5=CN=CC=C5

InChI

InChI=1S/C26H29N7O2/c1-30-14-22(12-29-30)15-32-18-25(35-20-21-5-2-8-27-11-21)17-31(19-26(32)34)16-24-7-4-10-33(24)23-6-3-9-28-13-23/h2-14,25H,15-20H2,1H3