azanium S-(3,4-dimethyl-1-oxidanyl-tetradecan-3-yl) N-ethylcarbamothioate hydrobromide

Systemtic Name: azanium S-(3,4-dimethyl-1-oxidanyl-tetradecan-3-yl) N-ethylcarbamothioate hydrobromide Openeye Name: ammonium S-[1-(2-hydroxyethyl)-1,2-dimethyl-dodecyl] N-ethylcarbamothioate hydrobromide CAS Name: ammonium N-ethylcarbamothioic acid S-(1-hydroxy-3,4-dimethyltetradecan-3-yl) ester hydrobromide IUPAC Name: azanium S-(1-hydroxy-3,4-dimethyltetradecan-3-yl) N-ethylcarbamothioate hydrobromide Traditional Name: ammonium N-ethylthiocarbamic acid S-[1-(2-hydroxyethyl)-1,2-dimethyl-dodecyl] ester hydrobromide Formula: C19H44BrN2O2S+ MolecularWeight: 444.53386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)C(C)(CCO)SC(=O)NCC.[NH4+].Br

Isomeric SMILES

CCCCCCCCCCC(C)C(C)(CCO)SC(=O)NCC.[NH4+].Br

InChI

InChI=1S/C19H39NO2S.BrH.H3N/c1-5-7-8-9-10-11-12-13-14-17(3)19(4,15-16-21)23-18(22)20-6-2;;/h17,21H,5-16H2,1-4H3,(H,20,22);1H;1H3/p+1