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

Systemtic Name: 6-[[4-(tert-butylamino)-6-(cyclopropylamino)-1,3,5-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one Openeye Name: 6-[[4-(tert-butylamino)-6-(cyclopropylamino)-1,3,5-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one CAS Name: 6-[[4-(tert-butylamino)-6-(cyclopropylamino)-1,3,5-triazin-2-yl]oxy]-2-phenyl-3-pyridazinone IUPAC Name: 6-[[4-(tert-butylamino)-6-(cyclopropylamino)-1,3,5-triazin-2-yl]oxy]-2-phenylpyridazin-3-one Traditional Name: 6-[[4-(tert-butylamino)-6-(cyclopropylamino)-s-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one Formula: C20H23N7O2 MolecularWeight: 393.44232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC(=N1)NC2CC2)OC3=NN(C(=O)C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)NC1=NC(=NC(=N1)NC2CC2)OC3=NN(C(=O)C=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H23N7O2/c1-20(2,3)25-18-22-17(21-13-9-10-13)23-19(24-18)29-15-11-12-16(28)27(26-15)14-7-5-4-6-8-14/h4-8,11-13H,9-10H2,1-3H3,(H2,21,22,23,24,25)