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

Systemtic Name: O-hexadecyl N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate Openeye Name: O-hexadecyl N-(3-methyl-1,1-dioxo-thiolan-3-yl)carbamothioate CAS Name: N-(3-methyl-1,1-dioxo-3-thiolanyl)carbamothioic acid O-hexadecyl ester IUPAC Name: O-hexadecyl N-(3-methyl-1,1-dioxothiolan-3-yl)carbamothioate Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)thiocarbamic acid O-cetyl ester Formula: C22H43NO3S2 MolecularWeight: 433.71172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=S)NC1(CCS(=O)(=O)C1)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=S)NC1(CCS(=O)(=O)C1)C

InChI

InChI=1S/C22H43NO3S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-26-21(27)23-22(2)17-19-28(24,25)20-22/h3-20H2,1-2H3,(H,23,27)