Vitas-M small molecule compound
2-ethyl 4-propan-2-yl 5-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK968459
SMILES CCOC(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)c1nn2c(n1)nc(cc2C(F)F)C
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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 C20H21F2N5O5S MW 481.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F2N5O5S/c1-6-31-19(30)13-10(5)12(18(29)32-8(2)3)17(33-13)25-16(28)15-24-20-23-9(4)7-11(14(21)22)27(20)26-15/h7-8,14H,6H2,1-5H3,(H,25,28)InChIKey
CYPQAWYZUAZTIY-UHFFFAOYSA-NSynonyms
675150-95-52ethyl4propan2yl5(((7(difluoromethyl)5methyl(124)triazolo(15a)pyrimidin2yl)carbonyl)amino)3methylthiophene24dicarboxylate
2OETHYL4OPROPAN2YL5((7(DIFLUOROMETHYL)5METHYL(124)TRIAZOLO(15A)PYRIMIDINE2CARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
675150955
CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=NN3C(=CC(=NC3=N2)C)C(F)F)C(=O)OC(C)C)C
InChI=1SC20H21F2N5O5Sc163119(30)1310(5)12(18(29)328(2)3)17(3313)2516(28)152420239(4)711(14(21)22)27(20)2615h7814H6H215H3(H2528)
MFCD02244087
ZINC000002770065
ZINC02770065
ZINC2770065
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