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(Q82589097)
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English
N-{6-Amino-1-butyl-3-[(2-fluorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl}-2-{4-[(pyridin-2-yl)sulfamoyl]phenyl}acetamide
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
580.1904172480001
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₈H₂₉FN₆O₅S
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canonical SMILES
CCCCN1C(=C(C(=O)N(C1=O)CC2=CC=CC=C2F)NC(=O)CC3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=N4)N
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Identifiers
InChI
InChI=1S/C28H29FN6O5S/c1-2-3-16-34-26(30)25(27(37)35(28(34)38)18-20-8-4-5-9-22(20)29)32-24(36)17-19-11-13-21(14-12-19)41(39,40)33-23-10-6-7-15-31-23/h4-15H,2-3,16-18,30H2,1H3,(H,31,33)(H,32,36)
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InChIKey
KKRYAISWWLDSGU-UHFFFAOYSA-N
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CAS Registry Number
748149-28-2
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PubChem CID
45118824
1 reference
matched by identifier from
InChIKey
InChIKey
KKRYAISWWLDSGU-UHFFFAOYSA-N
UniChem compound ID
29214578
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60668807
1 reference
matched by identifier from
InChIKey
InChIKey
KKRYAISWWLDSGU-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID60619556
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