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

Systemtic Name: methyl 2-[5-ethyl-2,4,6-tris(oxidanylidene)-5-pentylsulfanyl-1,3-diazinan-1-yl]tetradecanoate Openeye Name: methyl 2-(5-ethyl-2,4,6-trioxo-5-pentylsulfanyl-hexahydropyrimidin-1-yl)tetradecanoate CAS Name: 2-[5-ethyl-2,4,6-trioxo-5-(pentylthio)-1,3-diazinan-1-yl]tetradecanoic acid methyl ester IUPAC Name: methyl 2-(5-ethyl-2,4,6-trioxo-5-pentylsulfanyl-1,3-diazinan-1-yl)tetradecanoate Traditional Name: 2-[5-(amylthio)-5-ethyl-2,4,6-triketo-hexahydropyrimidin-1-yl]myristic acid methyl ester Formula: C26H46N2O5S MolecularWeight: 498.71884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H46N2O5S/c1-5-8-10-11-12-13-14-15-16-17-19-21(22(29)33-4)28-24(31)26(7-3,23(30)27-25(28)32)34-20-18-9-6-2/h21H,5-20H2,1-4H3,(H,27,30,32)