2-[18-oxidanyl-18-oxidanylidene-10-(2-sulfanidylethylazanidyl)octadecan-9-yl]azanidylethanethiolate; technetium-99

Systemtic Name: 2-[18-oxidanyl-18-oxidanylidene-10-(2-sulfanidylethylazanidyl)octadecan-9-yl]azanidylethanethiolate; technetium-99 Openeye Name: 2-[10-hydroxy-1-octyl-10-oxo-2-(2-sulfidoethylazanidyl)decyl]azanidylethanethiolate; technetium-99 CAS Name: 2-[18-hydroxy-18-oxo-10-(2-sulfidoethylazanidyl)octadecan-9-yl]azanidylethanethiolate; technetium-99 IUPAC Name: 2-[18-hydroxy-18-oxo-10-(2-sulfidoethylazanidyl)octadecan-9-yl]azanidylethanethiolate; technetium-99 Traditional Name: 2-[10-hydroxy-10-keto-1-octyl-2-(2-sulfidoethylazanidyl)decyl]azanidylethanethiolate; technetium-99 Formula: C22H42N2O2S2Tc-4 MolecularWeight: 529.617335

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CCCCCCCC(=O)O)[N-]CC[S-])[N-]CC[S-].[Tc]

Isomeric SMILES

CCCCCCCCC(C(CCCCCCCC(=O)O)[N-]CC[S-])[N-]CC[S-].[99Tc]

InChI

InChI=1S/C22H44N2O2S2.Tc/c1-2-3-4-5-7-10-13-20(23-16-18-27)21(24-17-19-28)14-11-8-6-9-12-15-22(25)26;/h20-21,27-28H,2-19H2,1H3,(H,25,26);/q-2;/p-2/i;1+1