5-chloranyl-2-ethylsulfanyl-pyrimidine-4-carboxylic acid

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-pyrimidine-4-carboxylic acid Openeye Name: 5-chloro-2-ethylsulfanyl-pyrimidine-4-carboxylic acid CAS Name: 5-chloro-2-(ethylthio)-4-pyrimidinecarboxylic acid IUPAC Name: 5-chloro-2-ethylsulfanylpyrimidine-4-carboxylic acid Traditional Name: 5-chloro-2-(ethylthio)pyrimidine-4-carboxylic acid Formula: C7H7ClN2O2S MolecularWeight: 218.66068

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)O)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)O)Cl

InChI

InChI=1S/C7H7ClN2O2S/c1-2-13-7-9-3-4(8)5(10-7)6(11)12/h3H,2H2,1H3,(H,11,12)