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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbonyl compound > ketone > aromatic ketone > benzophenones > rilmazafone hydrochloride
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > benzophenones > rilmazafone hydrochloride
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > benzophenones > rilmazafone hydrochloride

Preferred term

rilmazafone hydrochloride  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C21H20Cl2N6O3.HCl.2H2O
  • C21H25Cl3N6O5

inchi

  • InChI=1S/C21H20Cl2N6O3.ClH.2H2O/c1-28(2)21(32)20-26-17(11-25-18(30)10-24)29(27-20)16-8-7-12(22)9-14(16)19(31)13-5-3-4-6-15(13)23;;;/h3-9H,10-11,24H2,1-2H3,(H,25,30);1H;2*1H2

inchikey

  • UWTWLIQPJSLNEN-UHFFFAOYSA-N

mass

  • 547.820

monoisotopicmass

  • 546.09520

smiles

  • N1(C2=C(C(=O)C3=CC=CC=C3Cl)C=C(Cl)C=C2)C(=NC(C(=O)N(C)C)=N1)CNC(=O)CN.Cl.O.O

subset

  • 2_STAR

synonym EXACT

  • Rilmazafone hydrochloride

synonym RELATED

  • 5-[(2-aminoacetyl)aminomethyl]-1-[4-chloro-2-(2-chlorobenzoyl)-phenyl]-N,N-dimethyl-1H-1,2,4-triazole-3-carboxamide dihydrate hydrochloride
  • Rhythmy (TN)

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:32100

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