3-(2-ethoxyethyl)-2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfinyl-1,3-thiazol-3-ium

Systemtic Name: 3-(2-ethoxyethyl)-2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfinyl-1,3-thiazol-3-ium Openeye Name: 3-(2-ethoxyethyl)-2-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfinyl-thiazol-3-ium CAS Name: 3-(2-ethoxyethyl)-2-[3-octadecoxy-2-(2-pyrimidinyloxy)propyl]sulfinylthiazol-3-ium IUPAC Name: 3-(2-ethoxyethyl)-2-(3-octadecoxy-2-pyrimidin-2-yloxypropyl)sulfinyl-1,3-thiazol-3-ium Traditional Name: 3-(2-ethoxyethyl)-2-[2-(2-pyrimidyloxy)-3-stearyloxy-propyl]sulfinyl-thiazol-3-ium Formula: C32H56N3O4S2+ MolecularWeight: 610.93474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CS(=O)C1=[N+](C=CS1)CCOCC)OC2=NC=CC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CS(=O)C1=[N+](C=CS1)CCOCC)OC2=NC=CC=N2

InChI

InChI=1S/C32H56N3O4S2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-38-28-30(39-31-33-21-20-22-34-31)29-41(36)32-35(24-27-40-32)23-26-37-4-2/h20-22,24,27,30H,3-19,23,25-26,28-29H2,1-2H3/q+1