Vitas-M small molecule compound
6-(benzylsulfanyl)-4-(2-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Catalog ID
STK838388
SMILES N#CC1C(=O)NC(=C(C1c1ccccc1OC)C#N)SCc1ccccc1
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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 C21H17N3O2S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O2S/c1-26-18-10-6-5-9-15(18)19-16(11-22)20(25)24-21(17(19)12-23)27-13-14-7-3-2-4-8-14/h2-10,16,19H,13H2,1H3,(H,24,25)InChIKey
NWHPOYYUBVAVIP-UHFFFAOYSA-NSynonyms
6(benzylsulfanyl)4(2methoxyphenyl)2oxo1234tetrahydropyridine35dicarbonitrile
6(benzylthio)4(2methoxyphenyl)2oxo1234tetrahydropyridine35dicarbonitrile
6BENZYLSULFANYL4(2METHOXYPHENYL)2OXO34DIHYDRO1HPYRIDINE35DICARBONITRILE
COC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC3=CC=CC=C3)C#N
InChI=1SC21H17N3O2Sc126181065915(18)1916(1122)20(25)2421(17(19)1223)2713147324814h2101619H13H21H3(H2425)
MFCD02239056
ZINC000009012391
ZINC000009014535
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