zinc 6-azanyl-2-[6,8-bis(sulfanyl)octanoylamino]hexanoate

Systemtic Name: zinc 6-azanyl-2-[6,8-bis(sulfanyl)octanoylamino]hexanoate Openeye Name: zinc 6-amino-2-[6,8-bis(sulfanyl)octanoylamino]hexanoate CAS Name: zinc 6-amino-2-[(6,8-dimercapto-1-oxooctyl)amino]hexanoate IUPAC Name: zinc 6-amino-2-[6,8-bis(sulfanyl)octanoylamino]hexanoate Traditional Name: zinc 6-amino-2-(6,8-dimercaptooctanoylamino)hexanoate Formula: C28H54N4O6S4Zn MolecularWeight: 736.42056

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(=O)NC(CCCCN)C(=O)[O-])CC(CCS)S.C(CCC(=O)NC(CCCCN)C(=O)[O-])CC(CCS)S.[Zn+2]

Isomeric SMILES

C(CCC(=O)NC(CCCCN)C(=O)[O-])CC(CCS)S.C(CCC(=O)NC(CCCCN)C(=O)[O-])CC(CCS)S.[Zn+2]

InChI

InChI=1S/2C14H28N2O3S2.Zn/c2*15-9-4-3-6-12(14(18)19)16-13(17)7-2-1-5-11(21)8-10-20;/h2*11-12,20-21H,1-10,15H2,(H,16,17)(H,18,19);/q;;+2/p-2