2-(6-chloranyl-5-methanoyl-pyrimidin-4-yl)sulfanylethanoic acid

Systemtic Name: 2-(6-chloranyl-5-methanoyl-pyrimidin-4-yl)sulfanylethanoic acid Openeye Name: 2-(6-chloro-5-formyl-pyrimidin-4-yl)sulfanylacetic acid CAS Name: 2-[(6-chloro-5-formyl-4-pyrimidinyl)thio]acetic acid IUPAC Name: 2-(6-chloro-5-formylpyrimidin-4-yl)sulfanylacetic acid Traditional Name: 2-[(6-chloro-5-formyl-pyrimidin-4-yl)thio]acetic acid Formula: C7H5ClN2O3S MolecularWeight: 232.6442

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C(C(=N1)Cl)C=O)SCC(=O)O

Isomeric SMILES

C1=NC(=C(C(=N1)Cl)C=O)SCC(=O)O

InChI

InChI=1S/C7H5ClN2O3S/c8-6-4(1-11)7(10-3-9-6)14-2-5(12)13/h1,3H,2H2,(H,12,13)