barium(2+); 2-[bis(methylsulfanyl)methylidene]propanedioate; dihydrate

Systemtic Name: barium(2+); 2-[bis(methylsulfanyl)methylidene]propanedioate; dihydrate Openeye Name: barium(2+); 2-[bis(methylsulfanyl)methylene]propanedioate; dihydrate CAS Name: barium(2+); 2-[bis(methylthio)methylidene]propanedioate; dihydrate IUPAC Name: barium(2+); 2-[bis(methylsulfanyl)methylidene]propanedioate; dihydrate Traditional Name: barium(2+); 2-[bis(methylthio)methylene]malonate; dihydrate Formula: C6H10BaO6S2 MolecularWeight: 379.597

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C(=O)[O-])C(=O)[O-])SC.O.O.[Ba+2]

Isomeric SMILES

CSC(=C(C(=O)[O-])C(=O)[O-])SC.O.O.[Ba+2]

InChI

InChI=1S/C6H8O4S2.Ba.2H2O/c1-11-6(12-2)3(4(7)8)5(9)10;;;/h1-2H3,(H,7,8)(H,9,10);;2*1H2/q;+2;;/p-2