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

Systemtic Name: O-hexyl N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate Openeye Name: O-hexyl N-(3-methyl-1,1-dioxo-thiolan-3-yl)carbamothioate CAS Name: N-(3-methyl-1,1-dioxo-3-thiolanyl)carbamothioic acid O-hexyl ester IUPAC Name: O-hexyl N-(3-methyl-1,1-dioxothiolan-3-yl)carbamothioate Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)thiocarbamic acid O-hexyl ester Formula: C12H23NO3S2 MolecularWeight: 293.44592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23NO3S2/c1-3-4-5-6-8-16-11(17)13-12(2)7-9-18(14,15)10-12/h3-10H2,1-2H3,(H,13,17)