Vitas-M small molecule compound
2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-cyclohexylacetamide
Catalog ID
STK827660
SMILES CCOc1ccc(cc1)C1CC(=O)NC(=C1C#N)SCC(=O)NC1CCCCC1
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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 C22H27N3O3S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O3S/c1-2-28-17-10-8-15(9-11-17)18-12-20(26)25-22(19(18)13-23)29-14-21(27)24-16-6-4-3-5-7-16/h8-11,16,18H,2-7,12,14H2,1H3,(H,24,27)(H,25,26)InChIKey
SOKGJEWHAZYTKJ-UHFFFAOYSA-NSynonyms
683794-31-22((3cyano4(4ethoxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)Ncyclohexylacetamide
2((5CYANO4(4ETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)NCYCLOHEXYLACETAMIDE
683794312
CCOC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3CCCCC3
InChI=1SC22H27N3O3Sc12281710815(91117)181220(26)2522(19(18)1323)291421(27)24166435716h8111618H271214H21H3(H2427)(H2526)
MFCD03723885
ZINC000002836334
ZINC000002836335
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