Vitas-M small molecule compound
ethyl ({5-[5-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetate
Catalog ID
STK545044
SMILES CCOC(=O)CSc1nnc(o1)CCCCCn1c(=O)c2cccc3c2c(c1=O)ccc3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H23N3O5S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O5S/c1-2-30-19(27)14-32-23-25-24-18(31-23)12-4-3-5-13-26-21(28)16-10-6-8-15-9-7-11-17(20(15)16)22(26)29/h6-11H,2-5,12-14H2,1H3InChIKey
PDENIBCNFNVHFM-UHFFFAOYSA-NSynonyms
488709-31-5(5(5(13DIOXO1H3HBENZO(DE)ISOQUINOLIN2YL)PENTYL)(134)OXADIAZOL2YLSULFANYL)ACETICACIDETHYLESTER
488709315
CCOC(=O)CSC1=NN=C(O1)CCCCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O
ethyl((5(5(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)pentyl)134oxadiazol2yl)sulfanyl)acetate
ethyl2((5(5(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)pentyl)134oxadiazol2yl)thio)acetate
ETHYL2((5(5(13DIOXOBENZO(DE)ISOQUINOLIN2YL)PENTYL)134OXADIAZOL2YL)SULFANYL)ACETATE
InChI=1SC23H23N3O5Sc123019(27)143223252418(3123)12435132621(28)16106815971117(20(15)16)22(26)29h611H251214H21H3
MFCD03290803
ZINC000008830145
ZINC08830145
ZINC8830145
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