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(Q82921519)
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English
N-(2,4-Bis{[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]carbamoyl}phenyl)ethanimidic acid
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
509.5601
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₂₇N₇O₃
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canonical SMILES
CC(=O)NC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NCCN3)C(=O)NC4=CC=C(C=C4)C5=NCCN5
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Identifiers
InChI
InChI=1S/C28H27N7O3/c1-17(36)33-24-11-6-20(27(37)34-21-7-2-18(3-8-21)25-29-12-13-30-25)16-23(24)28(38)35-22-9-4-19(5-10-22)26-31-14-15-32-26/h2-11,16H,12-15H2,1H3,(H,29,30)(H,31,32)(H,33,36)(H,34,37)(H,35,38)
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InChIKey
KRXDLTPEZLUBGE-UHFFFAOYSA-N
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CAS Registry Number
21696-27-5
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PubChem CID
251787
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matched by identifier from
InChIKey
InChIKey
KRXDLTPEZLUBGE-UHFFFAOYSA-N
UniChem compound ID
66921209
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60944310
1 reference
matched by identifier from
InChIKey
InChIKey
KRXDLTPEZLUBGE-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID501372657
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NSC number
72565
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