Vitas-M small molecule compound
4-(4-ethylphenyl)-2-(hexylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK839021
SMILES CCCCCCSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)CC
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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 C20H26N2OS MW 342.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2OS/c1-3-5-6-7-12-24-20-18(14-21)17(13-19(23)22-20)16-10-8-15(4-2)9-11-16/h8-11,17H,3-7,12-13H2,1-2H3,(H,22,23)InChIKey
HJMXFIZDXVVASO-UHFFFAOYSA-NSynonyms
4(4ethylphenyl)2(hexylsulfanyl)6oxo1456tetrahydropyridine3carbonitrile
4(4ethylphenyl)2(hexylthio)6oxo1456tetrahydropyridine3carbonitrile
4(4ETHYLPHENYL)2HEXYLTHIO6OXO145TRIHYDROPYRIDINE3CARBONITRILE
4(4ETHYLPHENYL)6HEXYLSULFANYL2OXO34DIHYDRO1HPYRIDINE5CARBONITRILE
CCCCCCSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)CC)C#N
InChI=1SC20H26N2OSc1356712242018(1421)17(1319(23)2220)1610815(42)91116h81117H371213H212H3(H2223)
MFCD01832448
ZINC000009089324
ZINC000009089325
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