(5-bromanyl-6-oxidanylidene-4-pyrimidin-2-ylsulfanyl-pyridazin-1-yl)methyl ethanoate

Systemtic Name: (5-bromanyl-6-oxidanylidene-4-pyrimidin-2-ylsulfanyl-pyridazin-1-yl)methyl ethanoate Openeye Name: (5-bromo-6-oxo-4-pyrimidin-2-ylsulfanyl-pyridazin-1-yl)methyl acetate CAS Name: acetic acid [5-bromo-6-oxo-4-(2-pyrimidinylthio)-1-pyridazinyl]methyl ester IUPAC Name: (5-bromo-6-oxo-4-pyrimidin-2-ylsulfanylpyridazin-1-yl)methyl acetate Traditional Name: acetic acid [5-bromo-6-keto-4-(2-pyrimidylthio)pyridazin-1-yl]methyl ester Formula: C11H9BrN4O3S MolecularWeight: 357.18316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCN1C(=O)C(=C(C=N1)SC2=NC=CC=N2)Br

Isomeric SMILES

CC(=O)OCN1C(=O)C(=C(C=N1)SC2=NC=CC=N2)Br

InChI

InChI=1S/C11H9BrN4O3S/c1-7(17)19-6-16-10(18)9(12)8(5-15-16)20-11-13-3-2-4-14-11/h2-5H,6H2,1H3