Vitas-M small molecule compound
2-{[3-cyano-6-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK842576
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)F)NC(=O)CC1c1cc(OC)c(c(c1)OC)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 C23H22FN3O5S MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O5S/c1-30-18-8-13(9-19(31-2)22(18)32-3)16-10-20(28)27-23(17(16)11-25)33-12-21(29)26-15-6-4-14(24)5-7-15/h4-9,16H,10,12H2,1-3H3,(H,26,29)(H,27,28)InChIKey
BKRCGPPCLPJNHH-UHFFFAOYSA-NSynonyms
683794-45-82((3cyano6oxo4(345trimethoxyphenyl)1456tetrahydropyridin2yl)sulfanyl)N(4fluorophenyl)acetamide
2((3cyano6oxo4(345trimethoxyphenyl)1456tetrahydropyridin2yl)thio)N(4fluorophenyl)acetamide
2((5CYANO2OXO4(345TRIMETHOXYPHENYL)34DIHYDRO1HPYRIDIN6YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
683794458
COC1=CC(=CC(=C1OC)OC)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)F
InChI=1SC23H22FN3O5Sc13018813(919(312)22(18)323)161020(28)2723(17(16)1125)331221(29)26156414(24)5715h4916H1012H213H3(H2629)(H2728)
MFCD03664991
ZINC000009013742
ZINC000009013743
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