2,4-dimethyl-6-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2,4-dimethyl-6-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-pyrimidine-5-carboxylic acid Openeye Name: 2,4-dimethyl-6-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-pyrimidine-5-carboxylic acid CAS Name: 2,4-dimethyl-6-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-5-pyrimidinecarboxylic acid IUPAC Name: 2,4-dimethyl-6-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyrimidine-5-carboxylic acid Traditional Name: 4-[(2-keto-2-piperidino-ethyl)thio]-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C14H19N3O3S MolecularWeight: 309.38396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SCC(=O)N2CCCCC2)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SCC(=O)N2CCCCC2)C(=O)O

InChI

InChI=1S/C14H19N3O3S/c1-9-12(14(19)20)13(16-10(2)15-9)21-8-11(18)17-6-4-3-5-7-17/h3-8H2,1-2H3,(H,19,20)