CHEBI:116346 - 2-[4-(difluoromethylthio)anilino]benzoic acid [2-(cyclopropylamino)-2-oxoethyl] ester

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ChEBI Name 2-[4-(difluoromethylthio)anilino]benzoic acid [2-(cyclopropylamino)-2-oxoethyl] ester
ChEBI ID CHEBI:116346
Stars This entity has been manually annotated by a third party.
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Formula C19H18F2N2O3S
Net Charge 0
Average Mass 392.421
Monoisotopic Mass 392.10062
InChI InChI=1S/C19H18F2N2O3S/c20-19(21)27-14-9-7-12(8-10-14)22-16-4-2-1-3-15(16)18(25)26-11-17(24)23-13-5-6-13/h1-4,7-10,13,19,22H,5-6,11H2,(H,23,24)
InChIKey GUOFRHAUOGBFPY-UHFFFAOYSA-N
SMILES C1CC1NC(=O)COC(=O)C2=CC=CC=C2NC3=CC=C(C=C3)SC(F)F
ChEBI Ontology
Outgoing 2-[4-(difluoromethylthio)anilino]benzoic acid [2-(cyclopropylamino)-2-oxoethyl] ester (CHEBI:116346) is a benzoate ester (CHEBI:36054)
Manual Xref Database
LSM-27800 LINCS
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