Vitas-M small molecule compound
2-{[4-(1,3-benzodioxol-5-yl)-3-cyano-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Catalog ID
STK559152
SMILES N#CC1=C(SCC(=O)N)N=C2C(=C(O)CCC2)C1c1ccc2c(c1)OCO2
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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 C19H17N3O4S MW 383.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O4S/c20-7-11-17(10-4-5-14-15(6-10)26-9-25-14)18-12(2-1-3-13(18)23)22-19(11)27-8-16(21)24/h4-6,17,23H,1-3,8-9H2,(H2,21,24)InChIKey
XLQCEPLXQUIMFT-UHFFFAOYSA-NSynonyms
2((4(13benzodioxol5yl)3cyano5hydroxy4678tetrahydroquinolin2yl)sulfanyl)acetamide
MFCD03794831
ZINC000100088280
ZINC000100088281
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