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(Q82304253)
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English
9-cyclopropyl-6-fluoro-8-methoxy-7-(2-methylpyridin-4-yl)-9h-isothiazolo(5,4-b)quinoline-3,4-dione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
397.089640592
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₁₆FN₃O₃S
0 references
canonical SMILES
CC1=NC=CC(=C1)C2=C(C=C3C(=C2OC)N(C4=C(C3=O)C(=O)NS4)C5CC5)F
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Identifiers
InChI
InChI=1S/C20H16FN3O3S/c1-9-7-10(5-6-22-9)14-13(21)8-12-16(18(14)27-2)24(11-3-4-11)20-15(17(12)25)19(26)23-28-20/h5-8,11H,3-4H2,1-2H3,(H,23,26)
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InChIKey
XWDPBLFYPNKPFN-UHFFFAOYSA-N
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CAS Registry Number
906527-41-1
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PubChem CID
11844920
1 reference
matched by identifier from
InChIKey
InChIKey
XWDPBLFYPNKPFN-UHFFFAOYSA-N
UniChem compound ID
188762
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90474317
1 reference
matched by identifier from
InChIKey
InChIKey
XWDPBLFYPNKPFN-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID80425131
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