Vitas-M small molecule compound

2-{[3-cyano-4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide

Catalog ID
STK860676
SMILES CCOc1cc(ccc1O)C1CC(=O)NC(=C1C#N)SCC(=O)Nc1ccccc1C

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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 C23H23N3O4S MW 437.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O4S/c1-3-30-20-10-15(8-9-19(20)27)16-11-21(28)26-23(17(16)12-24)31-13-22(29)25-18-7-5-4-6-14(18)2/h4-10,16,27H,3,11,13H2,1-2H3,(H,25,29)(H,26,28)
InChIKey
NYTSJXUGVBFZCV-UHFFFAOYSA-N
Synonyms
375829-21-3
2((3cyano4(3ethoxy4hydroxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)N(2methylphenyl)acetamide
2((3cyano4(3ethoxy4hydroxyphenyl)6oxo1456tetrahydropyridin2yl)thio)N(otolyl)acetamide
2((5CYANO4(3ETHOXY4HYDROXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(2METHYLPHENYL)ACETAMIDE
375829213
CCOC1=C(C=CC(=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=CC=C3C)O
InChI=1SC23H23N3O4Sc1330201015(8919(20)27)161121(28)2623(17(16)1224)311322(29)2518754614(18)2h4101627H31113H212H3(H2529)(H2628)
MFCD02225519
ZINC000009110423
ZINC000009110424

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Available files

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