4-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid Openeye Name: 4-[(2-ethylthiazol-4-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid CAS Name: 4-[(2-ethyl-4-thiazolyl)methylthio]-2,6-dimethyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-2,6-dimethylpyrimidine-5-carboxylic acid Traditional Name: 4-[(2-ethylthiazol-4-yl)methylthio]-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C13H15N3O2S2 MolecularWeight: 309.4071

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CSC2=NC(=NC(=C2C(=O)O)C)C

Isomeric SMILES

CCC1=NC(=CS1)CSC2=NC(=NC(=C2C(=O)O)C)C

InChI

InChI=1S/C13H15N3O2S2/c1-4-10-16-9(5-19-10)6-20-12-11(13(17)18)7(2)14-8(3)15-12/h5H,4,6H2,1-3H3,(H,17,18)