Vitas-M small molecule compound
ethyl 2-({3-ethoxy-2-[(ethoxycarbonyl)amino]-1,1,1-trifluoro-3-oxopropan-2-yl}amino)-5-ethyl-4-phenylthiophene-3-carboxylate
Catalog ID
STK765552
SMILES CCOC(=O)NC(C(F)(F)F)(C(=O)OCC)Nc1sc(c(c1C(=O)OCC)c1ccccc1)CC
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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 C23H27F3N2O6S MW 516.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27F3N2O6S/c1-5-15-16(14-12-10-9-11-13-14)17(19(29)32-6-2)18(35-15)27-22(23(24,25)26,20(30)33-7-3)28-21(31)34-8-4/h9-13,27H,5-8H2,1-4H3,(H,28,31)InChIKey
NVMWXQLDGMNKJY-UHFFFAOYSA-NSynonyms
CCC1=C(C(=C(S1)NC(C(=O)OCC)(C(F)(F)F)NC(=O)OCC)C(=O)OCC)C2=CC=CC=C2
ethyl2((3ethoxy2((ethoxycarbonyl)amino)111trifluoro3oxopropan2yl)amino)5ethyl4phenylthiophene3carboxylate
ETHYL2((3ETHOXY2(ETHOXYCARBONYLAMINO)111TRIFLUORO3OXOPROPAN2YL)AMINO)5ETHYL4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H27F3N2O6Sc151516(1412109111314)17(19(29)3262)18(3515)2722(23(2425)2620(30)3373)2821(31)3484h91327H58H214H3(H2831)
MFCD02933798
ZINC000008854915
ZINC000012413119
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