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

Systemtic Name: 6-[[4-(azepan-1-yl)-6-(methylamino)-1,3,5-triazin-2-yl]oxy]-2-methyl-pyridazin-3-one Openeye Name: 6-[[4-(azepan-1-yl)-6-(methylamino)-1,3,5-triazin-2-yl]oxy]-2-methyl-pyridazin-3-one CAS Name: 6-[[4-(1-azepanyl)-6-(methylamino)-1,3,5-triazin-2-yl]oxy]-2-methyl-3-pyridazinone IUPAC Name: 6-[[4-(azepan-1-yl)-6-(methylamino)-1,3,5-triazin-2-yl]oxy]-2-methylpyridazin-3-one Traditional Name: 6-[[4-(azepan-1-yl)-6-(methylamino)-s-triazin-2-yl]oxy]-2-methyl-pyridazin-3-one Formula: C15H21N7O2 MolecularWeight: 331.37294

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC(=N1)N2CCCCCC2)OC3=NN(C(=O)C=C3)C

Isomeric SMILES

CNC1=NC(=NC(=N1)N2CCCCCC2)OC3=NN(C(=O)C=C3)C

InChI

InChI=1S/C15H21N7O2/c1-16-13-17-14(22-9-5-3-4-6-10-22)19-15(18-13)24-11-7-8-12(23)21(2)20-11/h7-8H,3-6,9-10H2,1-2H3,(H,16,17,18,19)