CHEBI:113001 - 5-(5-chloro-2-methoxyphenyl)-3H-1,3,4-oxadiazole-2-thione

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(5-chloro-2-methoxyphenyl)-3H-1,3,4-oxadiazole-2-thione
ChEBI ID CHEBI:113001
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C9H7ClN2O2S
Net Charge 0
Average Mass 242.683
Monoisotopic Mass 241.99168
InChI InChI=1S/C9H7ClN2O2S/c1-13-7-3-2-5(10)4-6(7)8-11-12-9(15)14-8/h2-4H,1H3,(H,12,15)
InChIKey FOBNNSSNVSMNMG-UHFFFAOYSA-N
SMILES COC1=C(C=C(C=C1)Cl)C2=NNC(=S)O2
ChEBI Ontology
Outgoing 5-(5-chloro-2-methoxyphenyl)-3H-1,3,4-oxadiazole-2-thione (CHEBI:113001) is a methoxybenzenes (CHEBI:51683)
Manual Xref Database
LSM-24411 LINCS
View more database links