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

Systemtic Name: methyl 5-[[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[6-(2,5-dimethylphenyl)-3-pyridazinyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[6-(2,5-dimethylphenyl)pyridazin-3-yl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN=C(C=C2)SCC3=CC=C(O3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN=C(C=C2)SCC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C19H18N2O3S/c1-12-4-5-13(2)15(10-12)16-7-9-18(21-20-16)25-11-14-6-8-17(24-14)19(22)23-3/h4-10H,11H2,1-3H3