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N-{2-[2,4-Bis(hydroxymethyl)-5-oxo-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]phenyl}-2,2,2-trifluoroethanimidic acid

HCID 360751
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Basic information

CAS
134793-43-4
Standard SMILES
O=C(Nc1ccccc1-c1nn(CO)c(=S)n(CO)c1=O)C(F)(F)F
InChIKey
SIFQRPDOTAOSPA-UHFFFAOYSA-N
Molecular formula
C13H11F3N4O4S
Average molar mass
376.316 g/mol
Monoisotopic mass
376.04531049

Names & identifiers

Preferred name
N-{2-[2,4-Bis(hydroxymethyl)-5-oxo-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]phenyl}-2,2,2-trifluoroethanimidic acid
IUPAC
N-{2-[2,4-Bis(hydroxymethyl)-5-oxo-3-sulfanylidene-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]phenyl}(trifluoro)ethanimidic acid
English name
Aids002928
Molecular formula
C13H11F3N4O4S
Molecular weight
376.3110496

Names & synonyms

Aids002928Aids-0029282,4-Di(hydroxymethyl)-3-thioxo-6-(2-trifluoroacetylaminophenyl)-1,2,4-triazine-5(2H,4H)oneAcetamide, 2,2,2-trifluoro-N-[2-[2,3,4,5-tetrahydro-2,4-bis(hydroxymethyl)-5-oxo-3-thioxo-1,2,4-triazin-6-yl]phenyl]-

Database identifiers

CAS
134793-43-4
PubChem CID
360751
DTXSID
DTXSID10928766
ChEMBL
CHEMBL1967807
Nikkaji
J370.061E

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