Vitas-M small molecule compound
2-[(3-methylbutyl)sulfanyl]-4-(2-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK887346
SMILES N#CC1=C(SCCC(C)C)NC(=O)CC1c1ccccc1C
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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)14-7-5-4-6-13(14)3/h4-7,12,15H,8-10H2,1-3H3,(H,20,21)InChIKey
XCMKKBBZBJMPJK-UHFFFAOYSA-NSynonyms
2((3methylbutyl)sulfanyl)4(2methylphenyl)6oxo1456tetrahydropyridine3carbonitrile
6(3METHYLBUTYLSULFANYL)4(2METHYLPHENYL)2OXO34DIHYDRO1HPYRIDINE5CARBONITRILE
CC1=CC=CC=C1C2CC(=O)NC(=C2C#N)SCCC(C)C
InChI=1SC18H22N2OSc112(2)89221816(1119)15(1017(21)2018)14754613(14)3h471215H810H213H3(H2021)
MFCD03000376
ZINC000000459083
ZINC000000459084
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