2-ethyl-4-[2-[ethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2-ethyl-4-[2-[ethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid Openeye Name: 2-ethyl-4-[2-[ethyl(methyl)amino]-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidine-5-carboxylic acid CAS Name: 2-ethyl-4-[[2-[ethyl(methyl)amino]-2-oxoethyl]thio]-6-methyl-5-pyrimidinecarboxylic acid IUPAC Name: 2-ethyl-4-[2-[ethyl(methyl)amino]-2-oxoethyl]sulfanyl-6-methylpyrimidine-5-carboxylic acid Traditional Name: 2-ethyl-4-[[2-[ethyl(methyl)amino]-2-keto-ethyl]thio]-6-methyl-pyrimidine-5-carboxylic acid Formula: C13H19N3O3S MolecularWeight: 297.37326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC(=O)N(C)CC)C(=O)O)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC(=O)N(C)CC)C(=O)O)C

InChI

InChI=1S/C13H19N3O3S/c1-5-9-14-8(3)11(13(18)19)12(15-9)20-7-10(17)16(4)6-2/h5-7H2,1-4H3,(H,18,19)