methyl 4-[[6-(furan-2-yl)pyridazin-3-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[6-(furan-2-yl)pyridazin-3-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[6-(2-furyl)pyridazin-3-yl]sulfanylmethyl]benzoate CAS Name: 4-[[[6-(2-furanyl)-3-pyridazinyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-(furan-2-yl)pyridazin-3-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[6-(2-furyl)pyridazin-3-yl]thio]methyl]benzoic acid methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NN=C(C=C2)C3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NN=C(C=C2)C3=CC=CO3

InChI

InChI=1S/C17H14N2O3S/c1-21-17(20)13-6-4-12(5-7-13)11-23-16-9-8-14(18-19-16)15-3-2-10-22-15/h2-10H,11H2,1H3