2-methyl-1-[2-(2-methyl-2-pent-4-enylsulfonio-propyl)azanidylphenyl]azanidyl-propane-2-thiolate; oxidanylidenetechnetium(3+)

Systemtic Name: 2-methyl-1-[2-(2-methyl-2-pent-4-enylsulfonio-propyl)azanidylphenyl]azanidyl-propane-2-thiolate; oxidanylidenetechnetium(3+) Openeye Name: 2-methyl-1-[2-(2-methyl-2-pent-4-enylsulfonio-propyl)azanidylphenyl]azanidyl-propane-2-thiolate; oxotechnetium(3+) CAS Name: 2-methyl-1-[2-(2-methyl-2-pent-4-enylsulfoniopropyl)azanidylphenyl]azanidyl-2-propanethiolate; oxotechnetium(3+) IUPAC Name: 2-methyl-1-[2-(2-methyl-2-pent-4-enylsulfoniopropyl)azanidylphenyl]azanidylpropane-2-thiolate; oxotechnetium(3+) Traditional Name: ketotechnetium(3+); 2-methyl-1-[2-(2-methyl-2-pent-4-enylsulfonio-propyl)azanidylphenyl]azanidyl-propane-2-thiolate Formula: C19H30N2OS2Tc+ MolecularWeight: 464.491516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[N-]C1=CC=CC=C1[N-]CC(C)(C)[SH+]CCCC=C)[S-].O=[Tc+3]

Isomeric SMILES

CC(C)(C[N-]C1=CC=CC=C1[N-]CC(C)(C)[SH+]CCCC=C)[S-].O=[Tc+3]

InChI

InChI=1S/C19H30N2S2.O.Tc/c1-6-7-10-13-23-19(4,5)15-21-17-12-9-8-11-16(17)20-14-18(2,3)22;;/h6,8-9,11-12,22H,1,7,10,13-15H2,2-5H3;;/q-2;;+3