hexadecyl N,N'-diethylcarbamimidothioate

Systemtic Name: hexadecyl N,N'-diethylcarbamimidothioate Openeye Name: 1,3-diethyl-2-hexadecyl-isothiourea CAS Name: N,N'-diethylcarbamimidothioic acid hexadecyl ester IUPAC Name: hexadecyl N,N'-diethylcarbamimidothioate Traditional Name: 2-cetyl-1,3-diethyl-isothiourea Formula: C21H44N2S MolecularWeight: 356.65246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC(=NCC)NCC

Isomeric SMILES

CCCCCCCCCCCCCCCCSC(=NCC)NCC

InChI

InChI=1S/C21H44N2S/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-21(22-5-2)23-6-3/h4-20H2,1-3H3,(H,22,23)