Vitas-M small molecule compound
ethyl 7-(3,5-difluorophenyl)-2-[(2-methoxy-2-oxoethyl)sulfanyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK232160
SMILES CCOC(=O)C1=C(C)Nc2n(C1c1cc(F)cc(c1)F)nc(n2)SCC(=O)OC
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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 C18H18F2N4O4S MW 424.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18F2N4O4S/c1-4-28-16(26)14-9(2)21-17-22-18(29-8-13(25)27-3)23-24(17)15(14)10-5-11(19)7-12(20)6-10/h5-7,15H,4,8H2,1-3H3,(H,21,22,23)InChIKey
DKKOAOFAAGOJIO-UHFFFAOYSA-NSynonyms
777871-35-9777871359
CCOC(=O)C1=C(N=C2N=C(NN2C1C3=CC(=CC(=C3)F)F)SCC(=O)OC)C
ethyl7(35difluorophenyl)2((2methoxy2oxoethyl)sulfanyl)5methyl47dihydro(124)triazolo(15a)pyrimidine6carboxylate
ethyl7(35difluorophenyl)2((2methoxy2oxoethyl)thio)5methyl47dihydro(124)triazolo(15a)pyrimidine6carboxylate
ETHYL7(35DIFLUOROPHENYL)2(2METHOXY2OXOETHYL)SULFANYL5METHYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
InChI=1SC18H18F2N4O4Sc142816(26)149(2)21172218(29813(25)273)2324(17)15(14)10511(19)712(20)610h5715H48H213H3(H212223)
METHYL2(7(35DIFLUOROPHENYL)6(ETHOXYCARBONYL)5METHYL478TRIHYDRO124TRIAZOLO(15A)PYRIMIDIN2YLTHIO)ACETATE
MFCD06606720
ZINC000013126975
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