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

Systemtic Name: 6-[[4-(tert-butylamino)-6-methylsulfanyl-1,3,5-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one Openeye Name: 6-[[4-(tert-butylamino)-6-methylsulfanyl-1,3,5-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one CAS Name: 6-[[4-(tert-butylamino)-6-(methylthio)-1,3,5-triazin-2-yl]oxy]-2-phenyl-3-pyridazinone IUPAC Name: 6-[[4-(tert-butylamino)-6-methylsulfanyl-1,3,5-triazin-2-yl]oxy]-2-phenylpyridazin-3-one Traditional Name: 6-[[4-(tert-butylamino)-6-(methylthio)-s-triazin-2-yl]oxy]-2-phenyl-pyridazin-3-one Formula: C18H20N6O2S MolecularWeight: 384.4554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC(=N1)SC)OC2=NN(C(=O)C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC1=NC(=NC(=N1)SC)OC2=NN(C(=O)C=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H20N6O2S/c1-18(2,3)22-15-19-16(21-17(20-15)27-4)26-13-10-11-14(25)24(23-13)12-8-6-5-7-9-12/h5-11H,1-4H3,(H,19,20,21,22)