O-hexadecyl N-[1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate

Systemtic Name: O-hexadecyl N-[1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate Openeye Name: O-hexadecyl N-(1,1-dioxothiolan-3-yl)carbamothioate CAS Name: N-(1,1-dioxo-3-thiolanyl)carbamothioic acid O-hexadecyl ester IUPAC Name: O-hexadecyl N-(1,1-dioxothiolan-3-yl)carbamothioate Traditional Name: N-(1,1-diketothiolan-3-yl)thiocarbamic acid O-cetyl ester Formula: C21H41NO3S2 MolecularWeight: 419.68514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=S)NC1CCS(=O)(=O)C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=S)NC1CCS(=O)(=O)C1

InChI

InChI=1S/C21H41NO3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-25-21(26)22-20-16-18-27(23,24)19-20/h20H,2-19H2,1H3,(H,22,26)