methyl 2-[5-ethyl-2,4,6-tris(oxidanylidene)-5-pentylsulfanyl-1,3-diazinan-1-yl]dodecanoate

Systemtic Name: methyl 2-[5-ethyl-2,4,6-tris(oxidanylidene)-5-pentylsulfanyl-1,3-diazinan-1-yl]dodecanoate Openeye Name: methyl 2-(5-ethyl-2,4,6-trioxo-5-pentylsulfanyl-hexahydropyrimidin-1-yl)dodecanoate CAS Name: 2-[5-ethyl-2,4,6-trioxo-5-(pentylthio)-1,3-diazinan-1-yl]dodecanoic acid methyl ester IUPAC Name: methyl 2-(5-ethyl-2,4,6-trioxo-5-pentylsulfanyl-1,3-diazinan-1-yl)dodecanoate Traditional Name: 2-[5-(amylthio)-5-ethyl-2,4,6-triketo-hexahydropyrimidin-1-yl]lauric acid methyl ester Formula: C24H42N2O5S MolecularWeight: 470.66568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)OC)N1C(=O)C(C(=O)NC1=O)(CC)SCCCCC

Isomeric SMILES

CCCCCCCCCCC(C(=O)OC)N1C(=O)C(C(=O)NC1=O)(CC)SCCCCC

InChI

InChI=1S/C24H42N2O5S/c1-5-8-10-11-12-13-14-15-17-19(20(27)31-4)26-22(29)24(7-3,21(28)25-23(26)30)32-18-16-9-6-2/h19H,5-18H2,1-4H3,(H,25,28,30)