Vitas-M small molecule compound
ethyl 4-cyano-5-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-3-methylthiophene-2-carboxylate
Catalog ID
STK960883
SMILES CCOC(=O)c1sc(c(c1C)C#N)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 C17H14F2N6O3S MW 420.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14F2N6O3S/c1-4-28-16(27)11-8(3)9(6-20)15(29-11)23-14(26)13-22-17-21-7(2)5-10(12(18)19)25(17)24-13/h5,12H,4H2,1-3H3,(H,23,26)InChIKey
RYQYNYALJWHZRK-UHFFFAOYSA-NSynonyms
445036-50-0445036500
CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=NN3C(=CC(=NC3=N2)C)C(F)F)C#N)C
ethyl4cyano5(((7(difluoromethyl)5methyl(124)triazolo(15a)pyrimidin2yl)carbonyl)amino)3methylthiophene2carboxylate
ETHYL4CYANO5((7(DIFLUOROMETHYL)5METHYL(124)TRIAZOLO(15A)PYRIMIDINE2CARBONYL)AMINO)3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC17H14F2N6O3Sc142816(27)118(3)9(620)15(2911)2314(26)132217217(2)510(12(18)19)25(17)2413h512H4H213H3(H2326)
MFCD02243409
ZINC000002769163
ZINC02769163
ZINC2769163
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