Vitas-M small molecule compound
2-[(3-methylbutyl)sulfanyl]-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK841059
SMILES N#CC1=C(SCCC(C)C)NC(=O)CC1c1ccc(cc1)C
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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 C18H22N2OS MW 314.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2OS/c1-12(2)8-9-22-18-16(11-19)15(10-17(21)20-18)14-6-4-13(3)5-7-14/h4-7,12,15H,8-10H2,1-3H3,(H,20,21)InChIKey
YBWRDKQXJNOTLP-UHFFFAOYSA-NSynonyms
488122-42-52((3methylbutyl)sulfanyl)4(4methylphenyl)6oxo1456tetrahydropyridine3carbonitrile
2(isopentylthio)6oxo4(ptolyl)1456tetrahydropyridine3carbonitrile
488122425
6(3METHYLBUTYLSULFANYL)4(4METHYLPHENYL)2OXO34DIHYDRO1HPYRIDINE5CARBONITRILE
CC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCCC(C)C
InChI=1SC18H22N2OSc112(2)89221816(1119)15(1017(21)2018)146413(3)5714h471215H810H213H3(H2021)
MFCD03289522
ZINC000009331811
ZINC000009331813
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