1-[5-(hexadecylsulfanylmethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[5-(hexadecylsulfanylmethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[5-(hexadecylsulfanylmethyl)-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[5-[(hexadecylthio)methyl]-4-hydroxy-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[5-(hexadecylsulfanylmethyl)-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[5-[(cetylthio)methyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C26H46N2O4S MolecularWeight: 482.71944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC1C(CC(O1)N2C=C(C(=O)NC2=O)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC1C(CC(O1)N2C=C(C(=O)NC2=O)C)O

InChI

InChI=1S/C26H46N2O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-33-20-23-22(29)18-24(32-23)28-19-21(2)25(30)27-26(28)31/h19,22-24,29H,3-18,20H2,1-2H3,(H,27,30,31)