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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic amide > 3-(4-methylphenyl)-n-[3-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolecarboxamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic amide > 3-(4-methylphenyl)-n-[3-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolecarboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > aromatic amide > 3-(4-methylphenyl)-n-[3-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolecarboxamide

Preferred term

3-(4-methylphenyl)-n-[3-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolecarboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C27H26N4O4S

inchi

  • InChI=1S/C27H26N4O4S/c1-20-10-12-21(13-11-20)26-25(19-31(29-26)23-7-3-2-4-8-23)27(32)28-22-6-5-9-24(18-22)36(33,34)30-14-16-35-17-15-30/h2-13,18-19H,14-17H2,1H3,(H,28,32)

inchikey

  • QQXGTKKFPYCAEN-UHFFFAOYSA-N

mass

  • 502.587

monoisotopicmass

  • 502.16748

smiles

  • CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:120418

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