barium(2+); N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-carbamothioate

Systemtic Name: barium(2+); N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-carbamothioate Openeye Name: barium(2+); N-(1,1-dioxothiolan-3-yl)-N-methyl-carbamothioate CAS Name: barium(2+); N-(1,1-dioxo-3-thiolanyl)-N-methylcarbamothioate IUPAC Name: barium(2+); N-(1,1-dioxothiolan-3-yl)-N-methylcarbamothioate Traditional Name: barium(2+); N-(1,1-diketothiolan-3-yl)-N-methyl-thiocarbamate Formula: C12H20BaN2O6S4 MolecularWeight: 553.884

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=S)[O-].CN(C1CCS(=O)(=O)C1)C(=S)[O-].[Ba+2]

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C(=S)[O-].CN(C1CCS(=O)(=O)C1)C(=S)[O-].[Ba+2]

InChI

InChI=1S/2C6H11NO3S2.Ba/c2*1-7(6(8)11)5-2-3-12(9,10)4-5;/h2*5H,2-4H2,1H3,(H,8,11);/q;;+2/p-2