Isatin-thiosemicarbazone-cpd13
AChE KI 0.94 +/- 0.13 microM; BChE KI 0.82 +/- 0.11 microM
General
Type : Urea derivative,Indole,Sulfur Compound
Chemical_Nomenclature : 1-benzyl-3-[(2-hydroxy-5-methoxy-1H-indol-3-yl)imino]thiourea
Canonical SMILES : COC1=CC2=C(C=C1)NC(=C2N=NC(=S)NCC3=CC=CC=C3)O
InChI : InChI=1S\/C17H16N4O2S\/c1-23-12-7-8-14-13(9-12)15(16(22)19-14)20-21-17(24)18-10-11-5-3-2-4-6-11\/h2-9,19,22H,10H2,1H3,(H,18,24)
InChIKey : FAPGKIBHGOCLQL-UHFFFAOYSA-N
Other name(s) : 3-(4-Benzylthiosemicarbazono)-5-methoxyindoline-2-one,(Z)-2-(5-methoxy-2-oxoindolin-3-ylidene)- N-benzyl-hydrazine-1-carbothioamide,(2Z)-N-Benzyl-2-(5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarbothioamide
MW : 340.4
Formula : C17H16N4O2S
CAS_number :
PubChem : 136756103
UniChem : FAPGKIBHGOCLQL-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : Isatin-thiosemicarbazone-cpd13 ligand of proteins in family: ACHE || BCHE
Stucture :
Protein :
References (1)
| Title : Determination of biological studies and molecular docking calculations of isatin-thiosemicarbazone hybrid compounds - Kocyigit_2022_J.Mol.Struct_1264_ |
| Author(s) : Kocyigit UM , Dogan M , Muglu H , Taslimi P , Tuzun B , Yakan H , Bal H , Guzel E , Gulci I |
| Ref : J Mol Struct , 1264 : , 2022 |
| Abstract : Kocyigit_2022_J.Mol.Struct_1264_ |
| ESTHER : Kocyigit_2022_J.Mol.Struct_1264_ |
| PubMedSearch : Kocyigit_2022_J.Mol.Struct_1264_ |
| PubMedID: |