MOLI000681

Molecular Formula: C₁₇H₂₂N₂O₄S₂Tc

InChI: InChI=1/C17H22N2O3S2.O.Tc/c1-10-9-14(20)15(16(21)22-10)11(2)18-7-8-19-13-6-4-5-12(13)17(23)24-3;;/h9,18-19H,4-8H2,1-3H3;;/b15-11+;;/i;;1+1/rC17H22N2O3S2.OTc/c1-10-9-14(20)15(16(21)22-10)11(2)18-7-8-19-13-6-4-5-12(13)17(23)24-3;1-2/h9,18-19H,4-8H2,1-3H3;/b15-11+;/i;2+1

InChIKey: InChIKey=PIGBCMNAUMDZCK-YSDIODPEFM
SMILES: CC1=CC(=O)C(=C(C)NCCNC2=C(CCC2)C(=S)SC)C(=O)O1.O=[Tc]

Names:
    MOLI000681
    (3E)-6-methyl-3-[1-[2-[(2-methylsulfanylcarbothioyl-1-cyclopentenyl)amino]ethylamino]ethylidene]pyran-2,4-dione; oxotechnetium

Registries:
    PubChem CID 5462051
    PubChem ID 668