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

Systemtic Name: O-octyl N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate Openeye Name: O-octyl N-(3-methyl-1,1-dioxo-thiolan-3-yl)carbamothioate CAS Name: N-(3-methyl-1,1-dioxo-3-thiolanyl)carbamothioic acid O-octyl ester IUPAC Name: O-octyl N-(3-methyl-1,1-dioxothiolan-3-yl)carbamothioate Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)thiocarbamic acid O-octyl ester Formula: C14H27NO3S2 MolecularWeight: 321.49908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H27NO3S2/c1-3-4-5-6-7-8-10-18-13(19)15-14(2)9-11-20(16,17)12-14/h3-12H2,1-2H3,(H,15,19)