5-chloranyl-2-propan-2-ylsulfanyl-pyrimidine-4-carboxylic acid

Systemtic Name: 5-chloranyl-2-propan-2-ylsulfanyl-pyrimidine-4-carboxylic acid Openeye Name: 5-chloro-2-isopropylsulfanyl-pyrimidine-4-carboxylic acid CAS Name: 5-chloro-2-(propan-2-ylthio)-4-pyrimidinecarboxylic acid IUPAC Name: 5-chloro-2-propan-2-ylsulfanylpyrimidine-4-carboxylic acid Traditional Name: 5-chloro-2-(isopropylthio)pyrimidine-4-carboxylic acid Formula: C8H9ClN2O2S MolecularWeight: 232.68726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC=C(C(=N1)C(=O)O)Cl

Isomeric SMILES

CC(C)SC1=NC=C(C(=N1)C(=O)O)Cl

InChI

InChI=1S/C8H9ClN2O2S/c1-4(2)14-8-10-3-5(9)6(11-8)7(12)13/h3-4H,1-2H3,(H,12,13)