6-[[4-(azepan-1-yl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]-2-methyl-pyridazin-3-one

Systemtic Name: 6-[[4-(azepan-1-yl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]-2-methyl-pyridazin-3-one Openeye Name: 6-[[4-(azepan-1-yl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]-2-methyl-pyridazin-3-one CAS Name: 6-[[4-(1-azepanyl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]-2-methyl-3-pyridazinone IUPAC Name: 6-[[4-(azepan-1-yl)-6-(dimethylamino)-1,3,5-triazin-2-yl]oxy]-2-methylpyridazin-3-one Traditional Name: 6-[[4-(azepan-1-yl)-6-(dimethylamino)-s-triazin-2-yl]oxy]-2-methyl-pyridazin-3-one Formula: C16H23N7O2 MolecularWeight: 345.39952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)OC2=NC(=NC(=N2)N(C)C)N3CCCCCC3

Isomeric SMILES

CN1C(=O)C=CC(=N1)OC2=NC(=NC(=N2)N(C)C)N3CCCCCC3

InChI

InChI=1S/C16H23N7O2/c1-21(2)14-17-15(23-10-6-4-5-7-11-23)19-16(18-14)25-12-8-9-13(24)22(3)20-12/h8-9H,4-7,10-11H2,1-3H3