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(Q2002)
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instance of
chemical compound
0 references
SMILES (without stereochemistry)
CN1C(=O)C2=C(NC1=O)N=CN2
0 references
chemical formula
C₆H₆N₄O₂
1 reference
based on heuristic
inferred from SMILES
mass
166.1377
1 reference
based on heuristic
inferred from SMILES
InChI
InChI=1S/C6H6N4O2/c1-10-5(11)3-4(8-2-7-3)9-6(10)12/h2H,1H3,(H,7,8)(H,9,12)
1 reference
based on heuristic
inferred from SMILES
InChIKey
MVOYJPOZRLFTCP-UHFFFAOYSA-N
0 references
PubChem CID
80220
1 reference
based on heuristic
inferred from InChIKey
xenobiotic metabolism pathway
WP3633
0 references