Vitas-M small molecule compound
butyl {[3-cyano-4-(2,3-dichlorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK538595
SMILES CCCCOC(=O)CSC1=C(C(CC(=O)N1)c1cccc(c1Cl)Cl)C#N
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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 C18H18Cl2N2O3S MW 413.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18Cl2N2O3S/c1-2-3-7-25-16(24)10-26-18-13(9-21)12(8-15(23)22-18)11-5-4-6-14(19)17(11)20/h4-6,12H,2-3,7-8,10H2,1H3,(H,22,23)InChIKey
ZVVKOIXSNIIEKX-UHFFFAOYSA-NSynonyms
370855-98-4370855984
butyl((3cyano4(23dichlorophenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
butyl2((3cyano4(23dichlorophenyl)6oxo1456tetrahydropyridin2yl)thio)acetate
BUTYL2((5CYANO4(23DICHLOROPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
CCCCOC(=O)CSC1=C(C(CC(=O)N1)C2=C(C(=CC=C2)Cl)Cl)C#N
InChI=1SC18H18Cl2N2O3Sc12372516(24)10261813(921)12(815(23)2218)1154614(19)17(11)20h4612H237810H21H3(H2223)
MFCD03000046
ZINC000009109253
ZINC000009109254
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