2-ethyl-4-methyl-6-(2-piperidin-1-ylethylsulfanyl)pyrimidine-5-carboxylic acid

Systemtic Name: 2-ethyl-4-methyl-6-(2-piperidin-1-ylethylsulfanyl)pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-methyl-6-[2-(1-piperidyl)ethylsulfanyl]pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-methyl-6-[2-(1-piperidinyl)ethylthio]-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-methyl-6-(2-piperidin-1-ylethylsulfanyl)pyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-methyl-6-(2-piperidinoethylthio)pyrimidine-5-carboxylic acid Formula: C15H23N3O2S MolecularWeight: 309.42702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCCN2CCCCC2)C(=O)O)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCCN2CCCCC2)C(=O)O)C

InChI

InChI=1S/C15H23N3O2S/c1-3-12-16-11(2)13(15(19)20)14(17-12)21-10-9-18-7-5-4-6-8-18/h3-10H2,1-2H3,(H,19,20)