2-phenyl-2-pyridazin-3-ylsulfanyl-ethanoic acid

Systemtic Name: 2-phenyl-2-pyridazin-3-ylsulfanyl-ethanoic acid Openeye Name: 2-phenyl-2-pyridazin-3-ylsulfanyl-acetic acid CAS Name: 2-phenyl-2-(3-pyridazinylthio)acetic acid IUPAC Name: 2-phenyl-2-pyridazin-3-ylsulfanylacetic acid Traditional Name: 2-phenyl-2-(pyridazin-3-ylthio)acetic acid Formula: C12H10N2O2S MolecularWeight: 246.285

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O2S/c15-12(16)11(9-5-2-1-3-6-9)17-10-7-4-8-13-14-10/h1-8,11H,(H,15,16)