O-ethyl 2-[2,4,6-tris(oxidanylidene)-5-propyl-1,3-diazinan-5-yl]ethylsulfanylmethanethioate

Systemtic Name: O-ethyl 2-[2,4,6-tris(oxidanylidene)-5-propyl-1,3-diazinan-5-yl]ethylsulfanylmethanethioate Openeye Name: O-ethyl 2-(2,4,6-trioxo-5-propyl-hexahydropyrimidin-5-yl)ethylsulfanylmethanethioate CAS Name: [2-(2,4,6-trioxo-5-propyl-1,3-diazinan-5-yl)ethylthio]methanethioic acid O-ethyl ester IUPAC Name: O-ethyl 2-(2,4,6-trioxo-5-propyl-1,3-diazinan-5-yl)ethylsulfanylmethanethioate Traditional Name: [2-(2,4,6-triketo-5-propyl-hexahydropyrimidin-5-yl)ethylthio]methanethioic acid O-ethyl ester Formula: C12H18N2O4S2 MolecularWeight: 318.41232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)NC(=O)NC1=O)CCSC(=S)OCC

Isomeric SMILES

CCCC1(C(=O)NC(=O)NC1=O)CCSC(=S)OCC

InChI

InChI=1S/C12H18N2O4S2/c1-3-5-12(6-7-20-11(19)18-4-2)8(15)13-10(17)14-9(12)16/h3-7H2,1-2H3,(H2,13,14,15,16,17)