Vitas-M small molecule compound
ethyl 5-cyano-4-(2-ethoxyphenyl)-6-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK541865
SMILES CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1OCC)C#N)SCC(=O)Nc1cccc(c1)OC
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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 C26H27N3O6S MW 509.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6S/c1-4-34-20-12-7-6-11-18(20)22-19(14-27)25(29-24(31)23(22)26(32)35-5-2)36-15-21(30)28-16-9-8-10-17(13-16)33-3/h6-13,22-23H,4-5,15H2,1-3H3,(H,28,30)(H,29,31)InChIKey
RZOJXCSVNZQLDG-UHFFFAOYSA-NSynonyms
488707-69-3488707693
CCOC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC(=O)NC3=CC(=CC=C3)OC)C(=O)OCC
ethyl5cyano4(2ethoxyphenyl)6((2((3methoxyphenyl)amino)2oxoethyl)sulfanyl)2oxo1234tetrahydropyridine3carboxylate
ethyl5cyano4(2ethoxyphenyl)6((2((3methoxyphenyl)amino)2oxoethyl)thio)2oxo1234tetrahydropyridine3carboxylate
ETHYL5CYANO4(2ETHOXYPHENYL)6(2(3METHOXYANILINO)2OXOETHYL)SULFANYL2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
InChI=1SC26H27N3O6Sc14342012761118(20)2219(1427)25(2924(31)23(22)26(32)3552)361521(30)2816981017(1316)333h6132223H4515H213H3(H2830)(H2931)
MFCD03290638
ZINC000009330715
ZINC000009374512
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