3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidanidyl-N-tridecyl-imidazolidin-3-ium-4-amine

Systemtic Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxidanidyl-N-tridecyl-imidazolidin-3-ium-4-amine Openeye Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-N-tridecyl-imidazolidin-3-ium-4-amine CAS Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-N-tridecyl-4-imidazolidin-3-iumamine IUPAC Name: 3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-N-tridecylimidazolidin-3-ium-4-amine Traditional Name: [3-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-1-methyl-3-oxido-imidazolidin-3-ium-4-yl]-tridecyl-amine Formula: C23H45N5OS MolecularWeight: 439.7013

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCNC1CN(C[N+]1(C2=NN=C(S2)C(C)(C)C)[O-])C

Isomeric SMILES

CCCCCCCCCCCCCNC1CN(C[N+]1(C2=NN=C(S2)C(C)(C)C)[O-])C

InChI

InChI=1S/C23H45N5OS/c1-6-7-8-9-10-11-12-13-14-15-16-17-24-20-18-27(5)19-28(20,29)22-26-25-21(30-22)23(2,3)4/h20,24H,6-19H2,1-5H3