methyl 2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]methyl]furan-3-carboxylic acid methyl ester Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=C(C=CO3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=C(C=CO3)C(=O)OC)C

InChI

InChI=1S/C16H16N4O3S/c1-10-8-11(2)20(19-10)14-4-5-15(18-17-14)24-9-13-12(6-7-23-13)16(21)22-3/h4-8H,9H2,1-3H3