MOLI000256
Molecular Formula:
C23H34ClN2O3S3Tc+
InChI: InChI=1/C18H24ClNO2S.C5H13NS2.O.Tc/c1-22-18(21)17-15(12-3-5-13(19)6-4-12)11-14-7-8-16(17)20(14)9-2-10-23;1-6(2-4-7)3-5-8;;/h3-6,14-17,23H,2,7-11H2,1H3;7-8H,2-5H2,1H3;;/q;;;+4/p-3/t14u,15-,16u,17+;;;/m1.../s1/i;;;1+1/fC18H23ClNO2S.C5H11NS2.O.Tc/h23h;7-8h;;/q-1;-2;;m/rC18H24ClNO2S.C5H13NS2.OTc/c1-22-18(21)17-15(12-3-5-13(19)6-4-12)11-14-7-8-16(17)20(14)9-2-10-23;1-6(2-4-7)3-5-8;1-2/h3-6,14-17,23H,2,7-11H2,1H3;7-8H,2-5H2,1H3;/q;;+4/p-3/t14u,15-,16u,17+;;/m1../s1/i;;2+1/fC18H23ClNO2S.C5H11NS2.OTc/h23h;7-8h;/q-1;-2;m
InChIKey: InChIKey=RVKDLUMPXYPCRF-PAJGCLSDHP
SMILES: CN(CC[S-])CC[S-].COC(=O)C1C2CCC(N2CCC[S-])CC1C3=CC=C(C=C3)Cl.O=[Tc+4]
Names:
MOLI000256
3-[(2S,3S)-3-(4-chlorophenyl)-2-methoxycarbonyl-8-azabicyclo[3.2.1]oct-8-yl]propane-1-thiolate; 2-(methyl-(2-sulfidoethyl)amino)ethanethiolate; oxotechnetium
Registries:
PubChem CID 6326822
PubChem ID 245
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