ethyl 2-[4-methyl-6-(1-methyl-6-oxidanylidene-pyridazin-3-yl)oxy-pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-methyl-6-(1-methyl-6-oxidanylidene-pyridazin-3-yl)oxy-pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-methyl-6-(1-methyl-6-oxo-pyridazin-3-yl)oxy-pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-methyl-6-[(1-methyl-6-oxo-3-pyridazinyl)oxy]-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-methyl-6-(1-methyl-6-oxopyridazin-3-yl)oxypyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(6-keto-1-methyl-pyridazin-3-yl)oxy-6-methyl-pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C14H16N4O4S MolecularWeight: 336.36624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=CC(=N1)OC2=NN(C(=O)C=C2)C)C

Isomeric SMILES

CCOC(=O)CSC1=NC(=CC(=N1)OC2=NN(C(=O)C=C2)C)C

InChI

InChI=1S/C14H16N4O4S/c1-4-21-13(20)8-23-14-15-9(2)7-11(16-14)22-10-5-6-12(19)18(3)17-10/h5-7H,4,8H2,1-3H3