dibutyltin(2+); 2-(sulfanylmethyl)icosanoate; sulfide

Systemtic Name: dibutyltin(2+); 2-(sulfanylmethyl)icosanoate; sulfide Openeye Name: dibutyltin(2+); 2-(sulfanylmethyl)icosanoate; sulfide CAS Name: dibutyltin(2+); 2-(mercaptomethyl)eicosanoate; sulfide IUPAC Name: dibutyltin(2+); 2-(sulfanylmethyl)icosanoate; sulfide Traditional Name: dibutyltin(2+); 2-(mercaptomethyl)arachidate; sulfide Formula: C100H200O8S5Sn2-2 MolecularWeight: 1928.3982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CS)C(=O)[O-].CCCCCCCCCCCCCCCCCCC(CS)C(=O)[O-].CCCCCCCCCCCCCCCCCCC(CS)C(=O)[O-].CCCCCCCCCCCCCCCCCCC(CS)C(=O)[O-].CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.[S-2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CS)C(=O)[O-].CCCCCCCCCCCCCCCCCCC(CS)C(=O)[O-].CCCCCCCCCCCCCCCCCCC(CS)C(=O)[O-].CCCCCCCCCCCCCCCCCCC(CS)C(=O)[O-].CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.[S-2]

InChI

InChI=1S/4C21H42O2S.4C4H9.S.2Sn/c4*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(19-24)21(22)23;4*1-3-4-2;;;/h4*20,24H,2-19H2,1H3,(H,22,23);4*1,3-4H2,2H3;;;/q;;;;;;;;-2;2*+2/p-4