Vitas-M small molecule compound
2-{[2-(biphenyl-4-yl)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK887363
SMILES COc1ccc(cc1)C1CC(=O)NC(=C1C#N)SCC(=O)c1ccc(cc1)c1ccccc1
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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 C27H22N2O3S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O3S/c1-32-22-13-11-20(12-14-22)23-15-26(31)29-27(24(23)16-28)33-17-25(30)21-9-7-19(8-10-21)18-5-3-2-4-6-18/h2-14,23H,15,17H2,1H3,(H,29,31)InChIKey
DQAMNUSTYKNXSV-UHFFFAOYSA-NSynonyms
2((2(biphenyl4yl)2oxoethyl)sulfanyl)4(4methoxyphenyl)6oxo1456tetrahydropyridine3carbonitrile
4(4methoxyphenyl)2oxo6(2oxo2(4phenylphenyl)ethyl)sulfanyl34dihydro1Hpyridine5carbonitrile
COC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
InChI=1SC27H22N2O3Sc13222131120(121422)231526(31)2927(24(23)1628)331725(30)219719(81021)185324618h21423H1517H21H3(H2931)
MFCD00315939
ZINC000040486357
ZINC000040486359
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