H1N

N-[2-OXO-3-((E)-PHENYL{[4-(PIPERIDIN-1-YLMETHYL)PHENYL]IMINO}METHYL)-2,6-DIHYDRO-1H-INDOL-5-YL]ETHANESULFONAMIDE


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Chemical Component Summary

NameN-[2-OXO-3-((E)-PHENYL{[4-(PIPERIDIN-1-YLMETHYL)PHENYL]IMINO}METHYL)-2,6-DIHYDRO-1H-INDOL-5-YL]ETHANESULFONAMIDE
SynonymsHESPERADIN
IdentifiersN-[2-oxo-3-[C-phenyl-N-[4-(piperidin-1-ylmethyl)phenyl]carbonimidoyl]-1,3-dihydroindol-5-yl]ethanesulfonamide
FormulaC29 H32 N4 O3 S
Molecular Weight516.654
TypeNON-POLYMER
Isomeric SMILESCCS(=O)(=O)Nc1ccc2c(c1)C(C(=O)N2)/C(=N/c3ccc(cc3)CN4CCCCC4)/c5ccccc5
InChIInChI=1S/C29H32N4O3S/c1-2-37(35,36)32-24-15-16-26-25(19-24)27(29(34)31-26)28(22-9-5-3-6-10-22)30-23-13-11-21(12-14-23)20-33-17-7-4-8-18-33/h3,5-6,9-16,19,27,32H,2,4,7-8,17-18,20H2,1H3,(H,31,34)/b30-28+/t27-/m0/s1
InChIKeySGZZQKMOFHIDKW-MCKMWFOCSA-N

Chemical Details

Formal Charge0
Atom Count69
Chiral Atom Count0
Bond Count73
Aromatic Bond Count22

Drug Info: DrugBank

DrugBank IDDB04703 
NameHesperidin
Groups
  • approved
  • investigational
DescriptionHesperidin is a flavan-on glycoside found in citrus fruits.
Synonyms
  • Ciratin
  • Cirantin
  • Hesperidoside
  • (S)-(−)-hesperidin
  • Hesperetin 7-O-rutinoside
Brand Names
  • Special C
  • Rose Hips 500plus Nu Life
  • Cilobana Cpa Tab
Categories
  • Benzopyrans
  • Carbohydrates
  • Chromones
  • Flavanones
  • Flavonoids
CAS number520-26-3

Drug Targets

NameTarget SequencePharmacological ActionActions
Aurora kinase BMAQKENSYPWPYGRQTAPSGLSTLPQRVLRKEPVTPSALVLMSRSNVQPT...unknownregulator
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682