Vitas-M small molecule compound
ethyl 4-(1-ethyl-1H-pyrazol-4-yl)-2-oxo-6-({[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK313738
SMILES CCOC(=O)C1=C(CSc2nccc(n2)C(F)(F)F)NC(=O)NC1c1cnn(c1)CC
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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 C18H19F3N6O3S MW 456.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19F3N6O3S/c1-3-27-8-10(7-23-27)14-13(15(28)30-4-2)11(24-16(29)26-14)9-31-17-22-6-5-12(25-17)18(19,20)21/h5-8,14H,3-4,9H2,1-2H3,(H2,24,26,29)InChIKey
CHRVZWDQQXWMNT-UHFFFAOYSA-NSynonyms
1005685-43-71005685437
CCN1C=C(C=N1)C2C(=C(NC(=O)N2)CSC3=NC=CC(=N3)C(F)(F)F)C(=O)OCC
ethyl4(1ethyl1Hpyrazol4yl)2oxo6(((4(trifluoromethyl)pyrimidin2yl)sulfanyl)methyl)1234tetrahydropyrimidine5carboxylate
ethyl4(1ethylpyrazol4yl)2oxo6((4(trifluoromethyl)pyrimidin2yl)sulfanylmethyl)34dihydro1Hpyrimidine5carboxylate
InChI=1SC18H19F3N6O3Sc1327810(72327)1413(15(28)3042)11(2416(29)2614)93117226512(2517)18(1920)21h5814H349H212H3(H2242629)
MFCD05667428
ZINC000013960555
ZINC000013960556
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