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(Q82222050)
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English
AC1NQXHP
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
237.003053844
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₉H₇N₃OS₂
0 references
canonical SMILES
Cc1ccc(C(=O)/N=C2/N=S=NS2)cc1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
CC1=CC=C(C=C1)C(=O)/N=C\2/N=S=NS2
0 references
Identifiers
InChI
InChI=1S/C9H7N3OS2/c1-6-2-4-7(5-3-6)8(13)10-9-11-15-12-14-9/h2-5H,1H3/b10-9-
0 references
InChIKey
KTVYUEOUKPWUGU-KTKRTIGZSA-N
0 references
CAS Registry Number
7240-21-3
0 references
DSSTox substance ID
DTXSID70413729
1 reference
matched by identifier from
InChIKey
InChIKey
KTVYUEOUKPWUGU-KTKRTIGZSA-N
DSSTOX compound identifier
DTXCID70364580
0 references
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