2-(2-chlorophenyl)-2-pyridazin-3-ylsulfanyl-ethanoic acid

Systemtic Name: 2-(2-chlorophenyl)-2-pyridazin-3-ylsulfanyl-ethanoic acid Openeye Name: 2-(2-chlorophenyl)-2-pyridazin-3-ylsulfanyl-acetic acid CAS Name: 2-(2-chlorophenyl)-2-(3-pyridazinylthio)acetic acid IUPAC Name: 2-(2-chlorophenyl)-2-pyridazin-3-ylsulfanylacetic acid Traditional Name: 2-(2-chlorophenyl)-2-(pyridazin-3-ylthio)acetic acid Formula: C12H9ClN2O2S MolecularWeight: 280.73006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C(=O)O)SC2=NN=CC=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(C(=O)O)SC2=NN=CC=C2)Cl

InChI

InChI=1S/C12H9ClN2O2S/c13-9-5-2-1-4-8(9)11(12(16)17)18-10-6-3-7-14-15-10/h1-7,11H,(H,16,17)