Vitas-M small molecule compound
butyl [(3-cyano-6-oxo-4-phenyl-1,4,5,6-tetrahydropyridin-2-yl)sulfanyl]acetate
Catalog ID
STK891190
SMILES CCCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccccc1
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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 C18H20N2O3S MW 344.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O3S/c1-2-3-9-23-17(22)12-24-18-15(11-19)14(10-16(21)20-18)13-7-5-4-6-8-13/h4-8,14H,2-3,9-10,12H2,1H3,(H,20,21)InChIKey
XHTWWDXDQVSRLE-UHFFFAOYSA-NSynonyms
332051-22-6332051226
butyl((3cyano6oxo4phenyl1456tetrahydropyridin2yl)sulfanyl)acetate
BUTYL2((5CYANO2OXO4PHENYL34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
CCCCOC(=O)CSC1=C(C(CC(=O)N1)C2=CC=CC=C2)C#N
InChI=1SC18H20N2O3Sc12392317(22)12241815(1119)14(1016(21)2018)137546813h4814H2391012H21H3(H2021)
MFCD01464768
ZINC000002474155
ZINC000002474156
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