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

Systemtic Name: 2-ethyl-4-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-6-methyl-pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-[(2-ethylthiazol-4-yl)methylsulfanyl]-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-[(2-ethyl-4-thiazolyl)methylthio]-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-6-methylpyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-[(2-ethylthiazol-4-yl)methylthio]-6-methyl-pyrimidine-5-carboxylic acid Formula: C14H17N3O2S2 MolecularWeight: 323.43368

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC2=CSC(=N2)CC)C(=O)O)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC2=CSC(=N2)CC)C(=O)O)C

InChI

InChI=1S/C14H17N3O2S2/c1-4-10-15-8(3)12(14(18)19)13(17-10)21-7-9-6-20-11(5-2)16-9/h6H,4-5,7H2,1-3H3,(H,18,19)