2-(3-ethyl-2-hexadecoxy-5-methylperoxy-1-oxidanidyl-imidazolidin-1-ium-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole

Systemtic Name: 2-(3-ethyl-2-hexadecoxy-5-methylperoxy-1-oxidanidyl-imidazolidin-1-ium-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole Openeye Name: 2-(3-ethyl-2-hexadecoxy-5-methylperoxy-1-oxido-imidazolidin-1-ium-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole CAS Name: 2-(3-ethyl-2-hexadecoxy-5-methyldioxy-1-oxido-1-imidazolidin-1-iumyl)-5-(trifluoromethyl)-1,3,4-thiadiazole IUPAC Name: 2-(3-ethyl-2-hexadecoxy-5-methylperoxy-1-oxidoimidazolidin-1-ium-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole Traditional Name: 2-(2-cetyloxy-3-ethyl-5-methylperoxy-1-oxido-imidazolidin-1-ium-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole Formula: C25H45F3N4O4S MolecularWeight: 554.70941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1N(CC([N+]1(C2=NN=C(S2)C(F)(F)F)[O-])OOC)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1N(CC([N+]1(C2=NN=C(S2)C(F)(F)F)[O-])OOC)CC

InChI

InChI=1S/C25H45F3N4O4S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-35-24-31(5-2)20-21(36-34-3)32(24,33)23-30-29-22(37-23)25(26,27)28/h21,24H,4-20H2,1-3H3