4-[(5-ethylthiophen-2-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[(5-ethylthiophen-2-yl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid Openeye Name: 4-[(5-ethyl-2-thienyl)methylsulfanyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid CAS Name: 4-[(5-ethyl-2-thiophenyl)methylthio]-2,6-dimethyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[(5-ethylthiophen-2-yl)methylsulfanyl]-2,6-dimethylpyrimidine-5-carboxylic acid Traditional Name: 4-[(5-ethyl-2-thienyl)methylthio]-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C14H16N2O2S2 MolecularWeight: 308.41904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CSC2=NC(=NC(=C2C(=O)O)C)C

Isomeric SMILES

CCC1=CC=C(S1)CSC2=NC(=NC(=C2C(=O)O)C)C

InChI

InChI=1S/C14H16N2O2S2/c1-4-10-5-6-11(20-10)7-19-13-12(14(17)18)8(2)15-9(3)16-13/h5-6H,4,7H2,1-3H3,(H,17,18)