Vitas-M small molecule compound
2-{[4-(2-chlorophenyl)-3-cyano-6-hydroxy-5-(thiophen-2-ylcarbonyl)-6-(trifluoromethyl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Catalog ID
STK827538
SMILES N#CC1=C(SCC(=O)Nc2ccc(cc2)F)NC(C(C1c1ccccc1Cl)C(=O)c1cccs1)(O)C(F)(F)F
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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 C26H18ClF4N3O3S2 MW 596.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18ClF4N3O3S2/c27-18-5-2-1-4-16(18)21-17(12-32)24(39-13-20(35)33-15-9-7-14(28)8-10-15)34-25(37,26(29,30)31)22(21)23(36)19-6-3-11-38-19/h1-11,21-22,34,37H,13H2,(H,33,35)InChIKey
CMFZMNNPSJUTDI-UHFFFAOYSA-NSynonyms
2((4(2chlorophenyl)3cyano6hydroxy5(thiophen2ylcarbonyl)6(trifluoromethyl)1456tetrahydropyridin2yl)sulfanyl)N(4fluorophenyl)acetamide
2((4(2chlorophenyl)5cyano2hydroxy3(thiophene2carbonyl)2(trifluoromethyl)34dihydro1Hpyridin6yl)sulfanyl)N(4fluorophenyl)acetamide
C1=CC=C(C(=C1)C2C(C(NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)F)(C(F)(F)F)O)C(=O)C4=CC=CS4)Cl
InChI=1SC26H18ClF4N3O3S2c2718521416(18)2117(1232)24(391320(35)33159714(28)81015)3425(3726(2930)31)22(21)23(36)1963113819h11121223437H13H2(H3335)
MFCD03827575
ZINC000103527269
ZINC000245294938
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