CHEBI:111203 - 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]propanoic acid methyl ester

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ChEBI Name 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]propanoic acid methyl ester
ChEBI ID CHEBI:111203
Stars This entity has been manually annotated by a third party.
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Formula C6H8N2O2S3
Net Charge 0
Average Mass 236.338
Monoisotopic Mass 235.97479
InChI InChI=1S/C6H8N2O2S3/c1-3(4(9)10-2)12-6-8-7-5(11)13-6/h3H,1-2H3,(H,7,11)
InChIKey OVFVNXZKMPNLJV-UHFFFAOYSA-N
SMILES CC(C(=O)OC)SC1=NNC(=S)S1
ChEBI Ontology
Outgoing 2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]propanoic acid methyl ester (CHEBI:111203) is a aryl sulfide (CHEBI:35683)
Manual Xref Database
LSM-22659 LINCS
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