6-[2-(2-chloroethylsulfanyl)-6-methyl-pyrimidin-4-yl]oxy-2-methyl-pyridazin-3-one

Systemtic Name: 6-[2-(2-chloroethylsulfanyl)-6-methyl-pyrimidin-4-yl]oxy-2-methyl-pyridazin-3-one Openeye Name: 6-[2-(2-chloroethylsulfanyl)-6-methyl-pyrimidin-4-yl]oxy-2-methyl-pyridazin-3-one CAS Name: 6-[[2-(2-chloroethylthio)-6-methyl-4-pyrimidinyl]oxy]-2-methyl-3-pyridazinone IUPAC Name: 6-[2-(2-chloroethylsulfanyl)-6-methylpyrimidin-4-yl]oxy-2-methylpyridazin-3-one Traditional Name: 6-[2-(2-chloroethylthio)-6-methyl-pyrimidin-4-yl]oxy-2-methyl-pyridazin-3-one Formula: C12H13ClN4O2S MolecularWeight: 312.77522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCCl)OC2=NN(C(=O)C=C2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCCCl)OC2=NN(C(=O)C=C2)C

InChI

InChI=1S/C12H13ClN4O2S/c1-8-7-10(15-12(14-8)20-6-5-13)19-9-3-4-11(18)17(2)16-9/h3-4,7H,5-6H2,1-2H3