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

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

CCCCNC1=NC(=NC(=N1)NC2CC2)OC3=NN(C(=O)C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCNC1=NC(=NC(=N1)NC2CC2)OC3=NN(C(=O)C=C3)C4=CC=CC=C4

InChI

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