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

Systemtic Name: [2,2-diethoxy-2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfinyl-ethyl]-trimethyl-azanium chloride Openeye Name: [2,2-diethoxy-2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfinyl-ethyl]-trimethyl-ammonium chloride CAS Name: [2,2-diethoxy-2-[3-octadecoxy-2-(2-pyrimidinyloxy)propyl]sulfinylethyl]-trimethylammonium chloride IUPAC Name: [2,2-diethoxy-2-(3-octadecoxy-2-pyrimidin-2-yloxypropyl)sulfinylethyl]-trimethylazanium chloride Traditional Name: [2,2-diethoxy-2-[2-(2-pyrimidyloxy)-3-stearyloxy-propyl]sulfinyl-ethyl]-trimethyl-ammonium chloride Formula: C34H66ClN3O5S MolecularWeight: 664.42294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H66N3O5S.ClH/c1-7-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-39-29-32(42-33-35-26-25-27-36-33)30-43(38)34(40-8-2,41-9-3)31-37(4,5)6;/h25-27,32H,7-24,28-31H2,1-6H3;1H/q+1;/p-1