2-[2-(5-chloranylpyridin-2-yl)sulfanylphenyl]ethanoic acid

Systemtic Name: 2-[2-(5-chloranylpyridin-2-yl)sulfanylphenyl]ethanoic acid Openeye Name: 2-[2-[(5-chloro-2-pyridyl)sulfanyl]phenyl]acetic acid CAS Name: 2-[2-[(5-chloro-2-pyridinyl)thio]phenyl]acetic acid IUPAC Name: 2-[2-(5-chloropyridin-2-yl)sulfanylphenyl]acetic acid Traditional Name: 2-[2-[(5-chloro-2-pyridyl)thio]phenyl]acetic acid Formula: C13H10ClNO2S MolecularWeight: 279.742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClNO2S/c14-10-5-6-12(15-8-10)18-11-4-2-1-3-9(11)7-13(16)17/h1-6,8H,7H2,(H,16,17)