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

Systemtic Name: 5-(1-butylsulfanylpropyl)-5-ethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-butylsulfanylpropyl)-5-ethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-(butylthio)propyl]-5-ethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1-butylsulfanylpropyl)-5-ethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[1-(butylthio)propyl]-5-ethyl-barbituric acid Formula: C13H22N2O3S MolecularWeight: 286.39038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(CC)C1(C(=O)NC(=O)NC1=O)CC

Isomeric SMILES

CCCCSC(CC)C1(C(=O)NC(=O)NC1=O)CC

InChI

InChI=1S/C13H22N2O3S/c1-4-7-8-19-9(5-2)13(6-3)10(16)14-12(18)15-11(13)17/h9H,4-8H2,1-3H3,(H2,14,15,16,17,18)