Vitas-M small molecule compound
ethyl 2-[({[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK546245
SMILES CCOC(=O)c1c(NC(=O)CSc2nc(cc(c2C#N)C(F)(F)F)c2ccccc2)sc2c1CCC2
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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 C25H20F3N3O3S2 MW 531.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20F3N3O3S2/c1-2-34-24(33)21-15-9-6-10-19(15)36-23(21)31-20(32)13-35-22-16(12-29)17(25(26,27)28)11-18(30-22)14-7-4-3-5-8-14/h3-5,7-8,11H,2,6,9-10,13H2,1H3,(H,31,32)InChIKey
BAKWPVXNCLDINA-UHFFFAOYSA-NSynonyms
445383-22-2445383222
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=C(C(=CC(=N3)C4=CC=CC=C4)C(F)(F)F)C#N
ETHYL2((((3CYANO6PHENYL4(TRIFLUOROMETHYL)2PYRIDINYL)SULFANYL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ethyl2((((3cyano6phenyl4(trifluoromethyl)pyridin2yl)sulfanyl)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2((2(3CYANO6PHENYL4(TRIFLUOROMETHYL)PYRIDIN2YL)SULFANYLACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ethyl2(2((3cyano6phenyl4(trifluoromethyl)pyridin2yl)thio)acetamido)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC25H20F3N3O3S2c123424(33)2115961019(15)3623(21)3120(32)13352216(1229)17(25(2627)28)1118(3022)147435814h357811H2691013H21H3(H3132)
MFCD03234582
ZINC000008451106
ZINC8451106
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.