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

Systemtic Name: O-pentadecyl N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]carbamothioate Openeye Name: O-pentadecyl N-[(1,1-dioxothiolan-3-yl)methyl]carbamothioate CAS Name: N-[(1,1-dioxo-3-thiolanyl)methyl]carbamothioic acid O-pentadecyl ester IUPAC Name: O-pentadecyl N-[(1,1-dioxothiolan-3-yl)methyl]carbamothioate Traditional Name: N-[(1,1-diketothiolan-3-yl)methyl]thiocarbamic acid O-pentadecyl ester Formula: C21H41NO3S2 MolecularWeight: 419.68514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC(=S)NCC1CCS(=O)(=O)C1

Isomeric SMILES

CCCCCCCCCCCCCCCOC(=S)NCC1CCS(=O)(=O)C1

InChI

InChI=1S/C21H41NO3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-25-21(26)22-18-20-15-17-27(23,24)19-20/h20H,2-19H2,1H3,(H,22,26)