Vitas-M small molecule compound
methyl 4-ethyl-5-methyl-2-({1,1,1-trifluoro-3-methoxy-3-oxo-2-[(phenylacetyl)amino]propan-2-yl}amino)thiophene-3-carboxylate
Catalog ID
STK792157
SMILES COC(=O)C(C(F)(F)F)(Nc1sc(c(c1C(=O)OC)CC)C)NC(=O)Cc1ccccc1
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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 C21H23F3N2O5S MW 472.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23F3N2O5S/c1-5-14-12(2)32-17(16(14)18(28)30-3)26-20(19(29)31-4,21(22,23)24)25-15(27)11-13-9-7-6-8-10-13/h6-10,26H,5,11H2,1-4H3,(H,25,27)InChIKey
LTVWVAKDZJAHAB-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(C(=O)OC)(C(F)(F)F)NC(=O)CC2=CC=CC=C2)C
InChI=1SC21H23F3N2O5Sc151412(2)3217(16(14)18(28)303)2620(19(29)31421(2223)24)2515(27)111397681013h61026H511H214H3(H2527)
METHYL2((4ETHYL3(METHOXYCARBONYL)5METHYL(2THIENYL))AMINO)333TRIFLUORO2(2PHENYLACETYLAMINO)PROPANOATE
METHYL4ETHYL5METHYL2((111TRIFLUORO3METHOXY3OXO2((2PHENYLACETYL)AMINO)PROPAN2YL)AMINO)THIOPHENE3CARBOXYLATE
methyl4ethyl5methyl2((111trifluoro3methoxy3oxo2((phenylacetyl)amino)propan2yl)amino)thiophene3carboxylate
MFCD03409321
ZINC000003622290
ZINC000003622292
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