ethyl 2-[3-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfanylethoxy]ethyl]-2H-imidazol-1-yl]hexanoate

Systemtic Name: ethyl 2-[3-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfanylethoxy]ethyl]-2H-imidazol-1-yl]hexanoate Openeye Name: ethyl 2-[3-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfanylethoxy]ethyl]-2H-imidazol-1-yl]hexanoate CAS Name: 2-[3-[2-[2-[[3-octadecoxy-2-(2-pyrimidinyloxy)propyl]thio]ethoxy]ethyl]-2H-imidazol-1-yl]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[3-[2-[2-(3-octadecoxy-2-pyrimidin-2-yloxypropyl)sulfanylethoxy]ethyl]-2H-imidazol-1-yl]hexanoate Traditional Name: 2-[3-[2-[2-[[2-(2-pyrimidyloxy)-3-stearyloxy-propyl]thio]ethoxy]ethyl]-4-imidazolin-1-yl]hexanoic acid ethyl ester Formula: C40H72N4O5S MolecularWeight: 721.08848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CSCCOCCN1CN(C=C1)C(CCCC)C(=O)OCC)OC2=NC=CC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CSCCOCCN1CN(C=C1)C(CCCC)C(=O)OCC)OC2=NC=CC=N2

InChI

InChI=1S/C40H72N4O5S/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-30-47-34-37(49-40-41-25-23-26-42-40)35-50-33-32-46-31-29-43-27-28-44(36-43)38(24-8-5-2)39(45)48-6-3/h23,25-28,37-38H,4-22,24,29-36H2,1-3H3