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

Systemtic Name: O-pentadecyl N-[1,1-bis(oxidanylidene)-2,5-dihydrothiophen-3-yl]carbamothioate Openeye Name: O-pentadecyl N-(1,1-dioxo-2,5-dihydrothiophen-3-yl)carbamothioate CAS Name: N-(1,1-dioxo-2,5-dihydrothiophen-3-yl)carbamothioic acid O-pentadecyl ester IUPAC Name: O-pentadecyl N-(1,1-dioxo-2,5-dihydrothiophen-3-yl)carbamothioate Traditional Name: N-(1,1-diketo-2,5-dihydrothiophen-3-yl)thiocarbamic acid O-pentadecyl ester Formula: C20H37NO3S2 MolecularWeight: 403.64268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H37NO3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-24-20(25)21-19-15-17-26(22,23)18-19/h15H,2-14,16-18H2,1H3,(H,21,25)