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Cu:pyrimidine-2,6-bis(thiocarboxylate)

PropertiesImage
MNX_IDMNXM11207 Image of MNXM11207
referencemetacycM:CPD-8208
formulaC7H4ClCuNO2S2
global charge0
mol weight297.247
InChIKeyGVBGAPCNCCWYCF-UHFFFAOYSA-K
InChIInChI=1S/C7H6NO2S2.ClH.Cu/c9-6(11)4-2-1-3-5(8-4)7(10)12;;/h1-4H,(H,9,11)(H,10,12);1H;/q-1;;+4/p-3
SMILESO=C1S[Cu]2(Cl)SC(=O)C3C=CC=C1N32
MNX internals
InChI (mnx)InChI=1/C7H6NO2S2.ClH.Cu/c9-6(11)4-2-1-3-5(8-4)7(10)12;;/h1-4H,(H,9,11)(H,10,12);1H;/q-1;;+4/t4?;; Image of MNXM11207
SMILES (mnx)[CH:1]1=[CH:2][CH:4]([C:6](=[O:9])[SH:11])[N-:8][C:5]([C:7](=[O:10])[SH:12])=[CH:3]1.[ClH:13].[Cu+4:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-8208
metacycM:CPD-8208
GVBGAPCNCCWYCF-UHFFFAOYSA-K
Cu:pyrimidine-2,6-bis(thiocarboxylate)
Cu:PDTC

seed.compound:cpd25093
seedM:cpd25093
GVBGAPCNCCWYCF-UHFFFAOYSA-K
Cu:PDTC
Cu:pyrimidine-2,6-bis(thiocarboxylate)

seedM:M_cpd25093
secondary/obsolete/fantasy identifier