Vitas-M small molecule compound
4-(4-ethoxyphenyl)-2-(hexylsulfanyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK700347
SMILES CCCCCCSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)OCC
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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 C20H26N2O2S MW 358.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O2S/c1-3-5-6-7-12-25-20-18(14-21)17(13-19(23)22-20)15-8-10-16(11-9-15)24-4-2/h8-11,17H,3-7,12-13H2,1-2H3,(H,22,23)InChIKey
DTOIXDIBAFFVKF-UHFFFAOYSA-NSynonyms
312509-73-2312509732
4(4ethoxyphenyl)2(hexylsulfanyl)6oxo1456tetrahydropyridine3carbonitrile
4(4ethoxyphenyl)2(hexylthio)6oxo1456tetrahydropyridine3carbonitrile
4(4ETHOXYPHENYL)6HEXYLSULFANYL2OXO34DIHYDRO1HPYRIDINE5CARBONITRILE
CCCCCCSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)OCC)C#N
InChI=1SC20H26N2O2Sc1356712252018(1421)17(1319(23)2220)1581016(11915)2442h81117H371213H212H3(H2223)
MFCD01461544
ZINC000008970006
ZINC000008972680
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