O-heptyl N-[1,1-bis(oxidanylidene)-2,5-dihydrothiophen-3-yl]carbamothioate

Systemtic Name: O-heptyl N-[1,1-bis(oxidanylidene)-2,5-dihydrothiophen-3-yl]carbamothioate Openeye Name: O-heptyl N-(1,1-dioxo-2,5-dihydrothiophen-3-yl)carbamothioate CAS Name: N-(1,1-dioxo-2,5-dihydrothiophen-3-yl)carbamothioic acid O-heptyl ester IUPAC Name: O-heptyl N-(1,1-dioxo-2,5-dihydrothiophen-3-yl)carbamothioate Traditional Name: N-(1,1-diketo-2,5-dihydrothiophen-3-yl)thiocarbamic acid O-heptyl ester Formula: C12H21NO3S2 MolecularWeight: 291.43004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=S)NC1=CCS(=O)(=O)C1

Isomeric SMILES

CCCCCCCOC(=S)NC1=CCS(=O)(=O)C1

InChI

InChI=1S/C12H21NO3S2/c1-2-3-4-5-6-8-16-12(17)13-11-7-9-18(14,15)10-11/h7H,2-6,8-10H2,1H3,(H,13,17)