4-chloranyl-3-pyridin-3-yl-1,2-thiazole-5-carboxylic acid

Systemtic Name: 4-chloranyl-3-pyridin-3-yl-1,2-thiazole-5-carboxylic acid Openeye Name: 4-chloro-3-(3-pyridyl)isothiazole-5-carboxylic acid CAS Name: 4-chloro-3-(3-pyridinyl)-5-isothiazolecarboxylic acid IUPAC Name: 4-chloro-3-pyridin-3-yl-1,2-thiazole-5-carboxylic acid Traditional Name: 4-chloro-3-(3-pyridyl)isothiazole-5-carboxylic acid Formula: C9H5ClN2O2S MolecularWeight: 240.6662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NSC(=C2Cl)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C2=NSC(=C2Cl)C(=O)O

InChI

InChI=1S/C9H5ClN2O2S/c10-6-7(5-2-1-3-11-4-5)12-15-8(6)9(13)14/h1-4H,(H,13,14)