CHEBI:116671 - 2-fluoro-N-[2,2,2-trichloro-1-[[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]amino]ethyl]acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-fluoro-N-[2,2,2-trichloro-1-[[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]amino]ethyl]acetamide
ChEBI ID CHEBI:116671
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C12H12Cl3FN4O4S
Net Charge 0
Average Mass 433.672
Monoisotopic Mass 431.96289
InChI InChI=1S/C12H12Cl3FN4O4S/c1-24-6-2-3-7(8(4-6)20(22)23)17-11(25)19-10(12(13,14)15)18-9(21)5-16/h2-4,10H,5H2,1H3,(H,18,21)(H2,17,19,25)
InChIKey MTIKLEXJGDGAHT-UHFFFAOYSA-N
SMILES COC1=CC(=C(C=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)CF)[N+](=O)[O-]
ChEBI Ontology
Outgoing 2-fluoro-N-[2,2,2-trichloro-1-[[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]amino]ethyl]acetamide (CHEBI:116671) is a C-nitro compound (CHEBI:35716)
2-fluoro-N-[2,2,2-trichloro-1-[[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]amino]ethyl]acetamide (CHEBI:116671) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-28126 LINCS
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