5-(2-butylsulfanylethyl)-2-methyl-1H-pyrimidine-4,6-dione

Systemtic Name: 5-(2-butylsulfanylethyl)-2-methyl-1H-pyrimidine-4,6-dione Openeye Name: 5-(2-butylsulfanylethyl)-2-methyl-1H-pyrimidine-4,6-dione CAS Name: 5-[2-(butylthio)ethyl]-2-methyl-1H-pyrimidine-4,6-dione IUPAC Name: 5-(2-butylsulfanylethyl)-2-methyl-1H-pyrimidine-4,6-dione Traditional Name: 5-[2-(butylthio)ethyl]-2-methyl-1H-pyrimidine-4,6-quinone Formula: C11H18N2O2S MolecularWeight: 242.33782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCC1C(=O)NC(=NC1=O)C

Isomeric SMILES

CCCCSCCC1C(=O)NC(=NC1=O)C

InChI

InChI=1S/C11H18N2O2S/c1-3-4-6-16-7-5-9-10(14)12-8(2)13-11(9)15/h9H,3-7H2,1-2H3,(H,12,13,14,15)