Type : Fragment inhibitor of Notum, Sulfur Compound, Carboxamide, Carbamate, Thiophen
Chemical_Nomenclature : N-methyl-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide
Canonical SMILES : CNC(=O)C1=CC2=C(S1)C3=CC=CC=C3CC2
InChI : InChI=1S\/C14H13NOS\/c1-15-14(16)12-8-10-7-6-9-4-2-3-5-11(9)13(10)17-12\/h2-5,8H,6-7H2,1H3,(H,15,16)
InChIKey : ADOUOUVBTDMDIV-UHFFFAOYSA-N
Other name(s) : MLS000721044 || N-methyl-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide || SMR000335230 || CHEMBL1560359 || ZINC1405579 || SCHEMBL20597479 || Fragment41
MW : 243.33
Formula : C14H13NOS
CAS_number : 320424-03-1
PubChem : 1490444
UniChem : ADOUOUVBTDMDIV-UHFFFAOYSA-N
Families : N-methyl-4,5-dihydronaphtho[1,2-b]thiophene-2-carboxamide ligand of proteins in family
Pectinacetylesterase-Notum
Structure :
7BND
Protein :
human-NOTUM
No reference