5-(3-butylsulfanylpropyl)-5-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(3-butylsulfanylpropyl)-5-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(3-butylsulfanylpropyl)-5-ethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[3-(butylthio)propyl]-5-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(3-butylsulfanylpropyl)-5-ethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[3-(butylthio)propyl]-5-ethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H22N2O2S2 MolecularWeight: 302.45598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCC1(C(=O)NC(=S)NC1=O)CC

Isomeric SMILES

CCCCSCCCC1(C(=O)NC(=S)NC1=O)CC

InChI

InChI=1S/C13H22N2O2S2/c1-3-5-8-19-9-6-7-13(4-2)10(16)14-12(18)15-11(13)17/h3-9H2,1-2H3,(H2,14,15,16,17,18)