Vitas-M small molecule compound
ethyl 7-(3,5-difluorophenyl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK232161
SMILES CCOC(=O)C1=C(C)Nc2n(C1c1cc(F)cc(c1)F)nc(n2)SC
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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 C16H16F2N4O2S MW 366.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16F2N4O2S/c1-4-24-14(23)12-8(2)19-15-20-16(25-3)21-22(15)13(12)9-5-10(17)7-11(18)6-9/h5-7,13H,4H2,1-3H3,(H,19,20,21)InChIKey
ZCTKQXRDLYHWQU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2N=C(NN2C1C3=CC(=CC(=C3)F)F)SC)C
ethyl7(35difluorophenyl)5methyl2(methylsulfanyl)47dihydro(124)triazolo(15a)pyrimidine6carboxylate
ETHYL7(35DIFLUOROPHENYL)5METHYL2METHYLSULFANYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL7(35DIFLUOROPHENYL)5METHYL2METHYLTHIO478TRIHYDRO124TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
InChI=1SC16H16F2N4O2Sc142414(23)128(2)19152016(253)2122(15)13(12)9510(17)711(18)69h5713H4H213H3(H192021)
MFCD06602838
ZINC000004488269
ZINC000004488270
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