2-chloranyl-6-propylsulfanyl-pyrimidine-4-carboxylic acid

Systemtic Name: 2-chloranyl-6-propylsulfanyl-pyrimidine-4-carboxylic acid Openeye Name: 2-chloro-6-propylsulfanyl-pyrimidine-4-carboxylic acid CAS Name: 2-chloro-6-(propylthio)-4-pyrimidinecarboxylic acid IUPAC Name: 2-chloro-6-propylsulfanylpyrimidine-4-carboxylic acid Traditional Name: 2-chloro-6-(propylthio)pyrimidine-4-carboxylic acid Formula: C8H9ClN2O2S MolecularWeight: 232.68726

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=NC(=C1)C(=O)O)Cl

Isomeric SMILES

CCCSC1=NC(=NC(=C1)C(=O)O)Cl

InChI

InChI=1S/C8H9ClN2O2S/c1-2-3-14-6-4-5(7(12)13)10-8(9)11-6/h4H,2-3H2,1H3,(H,12,13)