3-chloranyl-6-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]pyridine-2-carboxylic acid

Systemtic Name: 3-chloranyl-6-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]pyridine-2-carboxylic acid Openeye Name: 3-chloro-6-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]pyridine-2-carboxylic acid CAS Name: 3-chloro-6-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-2-pyridinecarboxylic acid IUPAC Name: 3-chloro-6-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]pyridine-2-carboxylic acid Traditional Name: 3-chloro-6-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]picolinic acid Formula: C11H8ClN3O3S MolecularWeight: 297.71752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC2=NC(=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC2=NC(=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C11H8ClN3O3S/c1-5-4-7(16)14-11(13-5)19-8-3-2-6(12)9(15-8)10(17)18/h2-4H,1H3,(H,17,18)(H,13,14,16)