2-(5-chloranylpyrimidin-2-yl)sulfanyl-2-(2-chlorophenyl)ethanoic acid

Systemtic Name: 2-(5-chloranylpyrimidin-2-yl)sulfanyl-2-(2-chlorophenyl)ethanoic acid Openeye Name: 2-(2-chlorophenyl)-2-(5-chloropyrimidin-2-yl)sulfanyl-acetic acid CAS Name: 2-(2-chlorophenyl)-2-[(5-chloro-2-pyrimidinyl)thio]acetic acid IUPAC Name: 2-(2-chlorophenyl)-2-(5-chloropyrimidin-2-yl)sulfanylacetic acid Traditional Name: 2-(2-chlorophenyl)-2-[(5-chloropyrimidin-2-yl)thio]acetic acid Formula: C12H8Cl2N2O2S MolecularWeight: 315.17512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C(=O)O)SC2=NC=C(C=N2)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(C(=O)O)SC2=NC=C(C=N2)Cl)Cl

InChI

InChI=1S/C12H8Cl2N2O2S/c13-7-5-15-12(16-6-7)19-10(11(17)18)8-3-1-2-4-9(8)14/h1-6,10H,(H,17,18)