[2-ethoxy-2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfinyl-ethyl]-trimethyl-azanium chloride

Systemtic Name: [2-ethoxy-2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfinyl-ethyl]-trimethyl-azanium chloride Openeye Name: [2-ethoxy-2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfinyl-ethyl]-trimethyl-ammonium chloride CAS Name: [2-ethoxy-2-[3-octadecoxy-2-(2-pyrimidinyloxy)propyl]sulfinylethyl]-trimethylammonium chloride IUPAC Name: [2-ethoxy-2-(3-octadecoxy-2-pyrimidin-2-yloxypropyl)sulfinylethyl]-trimethylazanium chloride Traditional Name: [2-ethoxy-2-[2-(2-pyrimidyloxy)-3-stearyloxy-propyl]sulfinyl-ethyl]-trimethyl-ammonium chloride Formula: C32H62ClN3O4S MolecularWeight: 620.37038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CS(=O)C(C[N+](C)(C)C)OCC)OC1=NC=CC=N1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CS(=O)C(C[N+](C)(C)C)OCC)OC1=NC=CC=N1.[Cl-]

InChI

InChI=1S/C32H62N3O4S.ClH/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-37-28-30(39-32-33-24-23-25-34-32)29-40(36)31(38-7-2)27-35(3,4)5;/h23-25,30-31H,6-22,26-29H2,1-5H3;1H/q+1;/p-1