ethyl 2-(1,5-dimethyl-4-oxidanylidene-pyrazolo[3,4-d]pyridazin-3-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(1,5-dimethyl-4-oxidanylidene-pyrazolo[3,4-d]pyridazin-3-yl)sulfanylethanoate Openeye Name: ethyl 2-(1,5-dimethyl-4-oxo-pyrazolo[3,4-d]pyridazin-3-yl)sulfanylacetate CAS Name: 2-[(1,5-dimethyl-4-oxo-3-pyrazolo[3,4-d]pyridazinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(1,5-dimethyl-4-oxopyrazolo[3,4-d]pyridazin-3-yl)sulfanylacetate Traditional Name: 2-[(4-keto-1,5-dimethyl-pyrazolo[3,4-d]pyridazin-3-yl)thio]acetic acid ethyl ester Formula: C11H14N4O3S MolecularWeight: 282.31886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN(C2=C1C(=O)N(N=C2)C)C

Isomeric SMILES

CCOC(=O)CSC1=NN(C2=C1C(=O)N(N=C2)C)C

InChI

InChI=1S/C11H14N4O3S/c1-4-18-8(16)6-19-10-9-7(14(2)13-10)5-12-15(3)11(9)17/h5H,4,6H2,1-3H3