6-[[4-(tert-butylamino)-6-(2-methylpropylamino)-1,3,5-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one

Systemtic Name: 6-[[4-(tert-butylamino)-6-(2-methylpropylamino)-1,3,5-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one Openeye Name: 6-[[4-(tert-butylamino)-6-(isobutylamino)-1,3,5-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one CAS Name: 6-[[4-(tert-butylamino)-6-(2-methylpropylamino)-1,3,5-triazin-2-yl]oxy]-2-phenyl-3-pyridazinone IUPAC Name: 6-[[4-(tert-butylamino)-6-(2-methylpropylamino)-1,3,5-triazin-2-yl]oxy]-2-phenylpyridazin-3-one Traditional Name: 6-[[4-(tert-butylamino)-6-(isobutylamino)-s-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one Formula: C21H27N7O2 MolecularWeight: 409.48478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=NC(=N1)OC2=NN(C(=O)C=C2)C3=CC=CC=C3)NC(C)(C)C

Isomeric SMILES

CC(C)CNC1=NC(=NC(=N1)OC2=NN(C(=O)C=C2)C3=CC=CC=C3)NC(C)(C)C

InChI

InChI=1S/C21H27N7O2/c1-14(2)13-22-18-23-19(26-21(3,4)5)25-20(24-18)30-16-11-12-17(29)28(27-16)15-9-7-6-8-10-15/h6-12,14H,13H2,1-5H3,(H2,22,23,24,25,26)