methyl 2-(6-pyrrol-1-ylpyridazin-3-yl)sulfanylethanoate

Systemtic Name: methyl 2-(6-pyrrol-1-ylpyridazin-3-yl)sulfanylethanoate Openeye Name: methyl 2-(6-pyrrol-1-ylpyridazin-3-yl)sulfanylacetate CAS Name: 2-[[6-(1-pyrrolyl)-3-pyridazinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-(6-pyrrol-1-ylpyridazin-3-yl)sulfanylacetate Traditional Name: 2-[(6-pyrrol-1-ylpyridazin-3-yl)thio]acetic acid methyl ester Formula: C11H11N3O2S MolecularWeight: 249.28894

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NN=C(C=C1)N2C=CC=C2

Isomeric SMILES

COC(=O)CSC1=NN=C(C=C1)N2C=CC=C2

InChI

InChI=1S/C11H11N3O2S/c1-16-11(15)8-17-10-5-4-9(12-13-10)14-6-2-3-7-14/h2-7H,8H2,1H3