O-hexadecyl N-[4-chloranyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate

Systemtic Name: O-hexadecyl N-[4-chloranyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate Openeye Name: O-hexadecyl N-(4-chloro-1,1-dioxo-thiolan-3-yl)carbamothioate CAS Name: N-(4-chloro-1,1-dioxo-3-thiolanyl)carbamothioic acid O-hexadecyl ester IUPAC Name: O-hexadecyl N-(4-chloro-1,1-dioxothiolan-3-yl)carbamothioate Traditional Name: N-(4-chloro-1,1-diketo-thiolan-3-yl)thiocarbamic acid O-cetyl ester Formula: C21H40ClNO3S2 MolecularWeight: 454.1302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=S)NC1CS(=O)(=O)CC1Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=S)NC1CS(=O)(=O)CC1Cl

InChI

InChI=1S/C21H40ClNO3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-26-21(27)23-20-18-28(24,25)17-19(20)22/h19-20H,2-18H2,1H3,(H,23,27)