CHEBI:109505 - 3-(carbamothioylhydrazinylidene)-N-[4-chloro-2-(trifluoromethyl)phenyl]butanamide

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ChEBI Name 3-(carbamothioylhydrazinylidene)-N-[4-chloro-2-(trifluoromethyl)phenyl]butanamide
ChEBI ID CHEBI:109505
Stars This entity has been manually annotated by a third party.
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Download Molfile XML SDF
Formula C12H12ClF3N4OS
Net Charge 0
Average Mass 352.765
Monoisotopic Mass 352.03724
InChI InChI=1S/C12H12ClF3N4OS/c1-6(19-20-11(17)22)4-10(21)18-9-3-2-7(13)5-8(9)12(14,15)16/h2-3,5H,4H2,1H3,(H,18,21)(H3,17,20,22)
InChIKey DYBCULMZPQWAIG-UHFFFAOYSA-N
SMILES CC(=NNC(=S)N)CC(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F
ChEBI Ontology
Outgoing 3-(carbamothioylhydrazinylidene)-N-[4-chloro-2-(trifluoromethyl)phenyl]butanamide (CHEBI:109505) is a (trifluoromethyl)benzenes (CHEBI:83565)
Manual Xref Database
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