oxidanylidenetechnetium-99(2+); (2S)-3-oxidanyl-3-oxidanylidene-2-[2-[(1-oxidanyl-1-oxidanylidene-3-sulfanidyl-propan-2-yl)amino]ethylamino]propane-1-thiolate

Systemtic Name: oxidanylidenetechnetium-99(2+); (2S)-3-oxidanyl-3-oxidanylidene-2-[2-[(1-oxidanyl-1-oxidanylidene-3-sulfanidyl-propan-2-yl)amino]ethylamino]propane-1-thiolate Openeye Name: (2S)-3-hydroxy-2-[2-[[2-hydroxy-2-oxo-1-(sulfidomethyl)ethyl]amino]ethylamino]-3-oxo-propane-1-thiolate; oxotechnetium-99(2+) CAS Name: (2S)-3-hydroxy-2-[2-[(1-hydroxy-1-oxo-3-sulfidopropan-2-yl)amino]ethylamino]-3-oxo-1-propanethiolate; oxotechnetium-99(2+) IUPAC Name: (2S)-3-hydroxy-2-[2-[(1-hydroxy-1-oxo-3-sulfidopropan-2-yl)amino]ethylamino]-3-oxopropane-1-thiolate; oxotechnetium-99(2+) Traditional Name: (2S)-3-hydroxy-2-[2-[[2-hydroxy-2-keto-1-(sulfidomethyl)ethyl]amino]ethylamino]-3-keto-propane-1-thiolate; ketotechnetium-99(2+) Formula: C8H14N2O5S2Tc MolecularWeight: 381.243415

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Descriptors Computed from Structure

Canonical SMILES:

C(CNC(C[S-])C(=O)O)NC(C[S-])C(=O)O.O=[Tc+2]

Isomeric SMILES

C(CNC(C[S-])C(=O)O)N[C@H](C[S-])C(=O)O.O=[99Tc+2]

InChI

InChI=1S/C8H16N2O4S2.O.Tc/c11-7(12)5(3-15)9-1-2-10-6(4-16)8(13)14;;/h5-6,9-10,15-16H,1-4H2,(H,11,12)(H,13,14);;/q;;+2/p-2/t5-,6?;;/m1../s1/i;;1+1