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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > azole > triazoles > 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-n-(3-methoxyphenyl)-2-phenylacetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > azole > triazoles > 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-n-(3-methoxyphenyl)-2-phenylacetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > heteroarene > monocyclic heteroarene > azole > triazoles > 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-n-(3-methoxyphenyl)-2-phenylacetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > heteroarene > monocyclic heteroarene > azole > triazoles > 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-n-(3-methoxyphenyl)-2-phenylacetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > heteroarene > monocyclic heteroarene > azole > triazoles > 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-n-(3-methoxyphenyl)-2-phenylacetamide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > heteroarene > monocyclic heteroarene > azole > triazoles > 2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-n-(3-methoxyphenyl)-2-phenylacetamide

Preferred term

2-[[4-(4-chlorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-n-(3-methoxyphenyl)-2-phenylacetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C28H22ClN5O2S

inchi

  • InChI=1S/C28H22ClN5O2S/c1-36-24-9-5-8-22(18-24)31-27(35)25(19-6-3-2-4-7-19)37-28-33-32-26(20-14-16-30-17-15-20)34(28)23-12-10-21(29)11-13-23/h2-18,25H,1H3,(H,31,35)

inchikey

  • HEDGTPHWTWKAIJ-UHFFFAOYSA-N

mass

  • 528.027

monoisotopicmass

  • 527.11827

smiles

  • COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3C4=CC=C(C=C4)Cl)C5=CC=NC=C5

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:111438

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