MOLI000675
Molecular Formula:
C16H19N3O4S2Tc
InChI: InChI=1/C16H19N3O3S2.O.Tc/c1-24-16(23)13-3-2-4-14(13)18-8-7-17-10-11-9-12(19(21)22)5-6-15(11)20;;/h5-6,9-10,17-18H,2-4,7-8H2,1H3;;/b11-10-;;/i;;1+1/rC16H19N3O3S2.OTc/c1-24-16(23)13-3-2-4-14(13)18-8-7-17-10-11-9-12(19(21)22)5-6-15(11)20;1-2/h5-6,9-10,17-18H,2-4,7-8H2,1H3;/b11-10-;/i;2+1
InChIKey: InChIKey=KTIQOGXIXMSYEA-XSWHKSBLFX
SMILES: CSC(=S)C1=C(CCC1)NCCNC=C2C=C(C=CC2=O)[N+](=O)[O-].O=[Tc]
Names:
MOLI000675
(6Z)-6-[[2-[(2-methylsulfanylcarbothioyl-1-cyclopentenyl)amino]ethylamino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one; oxotechnetium
Registries:
PubChem CID 5462045
PubChem ID 662
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