MOLI000671
Molecular Formula:
C16H20N2O2S2Tc
InChI: InChI=1/C16H20N2OS2.O.Tc/c1-21-16(20)13-6-4-7-14(13)18-10-9-17-11-12-5-2-3-8-15(12)19;;/h2-3,5,8,11,17-18H,4,6-7,9-10H2,1H3;;/b12-11-;;/i;;1+1/rC16H20N2OS2.OTc/c1-21-16(20)13-6-4-7-14(13)18-10-9-17-11-12-5-2-3-8-15(12)19;1-2/h2-3,5,8,11,17-18H,4,6-7,9-10H2,1H3;/b12-11-;/i;2+1
InChIKey: InChIKey=HXPUHJBQTAZOIA-WVWHIGIIFM
SMILES: CSC(=S)C1=C(CCC1)NCCNC=C2C=CC=CC2=O.O=[Tc]
Names:
MOLI000671
(6Z)-6-[[2-[(2-methylsulfanylcarbothioyl-1-cyclopentenyl)amino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one; oxotechnetium
Registries:
PubChem CID 5462041
PubChem ID 658
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