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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > heteroarene > polycyclic heteroarene > benzopyrrole > indoles > 2-[[1-[(3-bromophenyl)methyl]-3-indolyl]sulfonyl]-n-(5-methyl-3-isoxazolyl)acetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > heteroarene > polycyclic heteroarene > benzopyrrole > indoles > 2-[[1-[(3-bromophenyl)methyl]-3-indolyl]sulfonyl]-n-(5-methyl-3-isoxazolyl)acetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > heteroarene > polycyclic heteroarene > benzopyrrole > indoles > 2-[[1-[(3-bromophenyl)methyl]-3-indolyl]sulfonyl]-n-(5-methyl-3-isoxazolyl)acetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > heteroarene > polycyclic heteroarene > benzopyrrole > indoles > 2-[[1-[(3-bromophenyl)methyl]-3-indolyl]sulfonyl]-n-(5-methyl-3-isoxazolyl)acetamide

Preferred term

2-[[1-[(3-bromophenyl)methyl]-3-indolyl]sulfonyl]-n-(5-methyl-3-isoxazolyl)acetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C21H18BrN3O4S

inchi

  • InChI=1S/C21H18BrN3O4S/c1-14-9-20(24-29-14)23-21(26)13-30(27,28)19-12-25(18-8-3-2-7-17(18)19)11-15-5-4-6-16(22)10-15/h2-10,12H,11,13H2,1H3,(H,23,24,26)

inchikey

  • QETZNYYAKOOMBS-UHFFFAOYSA-N

mass

  • 488.356

monoisotopicmass

  • 487.02014

smiles

  • CC1=CC(=NO1)NC(=O)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC4=CC(=CC=C4)Br

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:92036

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