N-hexyl-1-methyl-3-oxidanidyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-amine

Systemtic Name: N-hexyl-1-methyl-3-oxidanidyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-amine Openeye Name: N-hexyl-1-methyl-3-oxido-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-amine CAS Name: N-hexyl-1-methyl-3-oxido-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-4-imidazolidin-3-iumamine IUPAC Name: N-hexyl-1-methyl-3-oxido-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-amine Traditional Name: hexyl-[1-methyl-3-oxido-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-yl]amine Formula: C13H22F3N5OS MolecularWeight: 353.40689

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1CN(C[N+]1(C2=NN=C(S2)C(F)(F)F)[O-])C

Isomeric SMILES

CCCCCCNC1CN(C[N+]1(C2=NN=C(S2)C(F)(F)F)[O-])C

InChI

InChI=1S/C13H22F3N5OS/c1-3-4-5-6-7-17-10-8-20(2)9-21(10,22)12-19-18-11(23-12)13(14,15)16/h10,17H,3-9H2,1-2H3