butyltin; butyltin(3+); 2-(6-methylheptoxy)-2-oxidanylidene-ethanethiolate; sulfanide

Systemtic Name: butyltin; butyltin(3+); 2-(6-methylheptoxy)-2-oxidanylidene-ethanethiolate; sulfanide Openeye Name: butyltin; butyltin(3+); 2-(6-methylheptoxy)-2-oxo-ethanethiolate; sulfanide CAS Name: butyltin; butyltin(3+); 2-(6-methylheptoxy)-2-oxoethanethiolate; sulfanide IUPAC Name: butyltin; butyltin(3+); 2-(6-methylheptoxy)-2-oxoethanethiolate; sulfanide Traditional Name: butyltin; butyltin(3+); 2-keto-2-(6-methylheptoxy)ethanethiolate; bisulfide Formula: C48H95O8S5Sn2-2 MolecularWeight: 1198.0081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn].CCCC[Sn+3].CC(C)CCCCCOC(=O)C[S-].CC(C)CCCCCOC(=O)C[S-].CC(C)CCCCCOC(=O)C[S-].CC(C)CCCCCOC(=O)C[S-].[SH-]

Isomeric SMILES

CCCC[Sn].CCCC[Sn+3].CC(C)CCCCCOC(=O)C[S-].CC(C)CCCCCOC(=O)C[S-].CC(C)CCCCCOC(=O)C[S-].CC(C)CCCCCOC(=O)C[S-].[SH-]

InChI

InChI=1S/4C10H20O2S.2C4H9.H2S.2Sn/c4*1-9(2)6-4-3-5-7-12-10(11)8-13;2*1-3-4-2;;;/h4*9,13H,3-8H2,1-2H3;2*1,3-4H2,2H3;1H2;;/q;;;;;;;;+3/p-5