Vitas-M small molecule compound
(2E)-N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3-phenylprop-2-enamide
Catalog ID
STK653059
SMILES O=C(Nc1nn2c(=NC(=CC2c2ccc(cc2)F)c2ccc(cc2)Cl)[nH]1)/C=C/c1ccccc1
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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 C26H19ClFN5O MW 471.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19ClFN5O/c27-20-11-7-18(8-12-20)22-16-23(19-9-13-21(28)14-10-19)33-26(29-22)31-25(32-33)30-24(34)15-6-17-4-2-1-3-5-17/h1-16,23H,(H2,29,30,31,32,34)/b15-6+InChIKey
CLPQSMUBHOINBD-GIDUJCDVSA-NSynonyms
840456-20-4(2E)N(5(4chlorophenyl)7(4fluorophenyl)37dihydro(124)triazolo(15a)pyrimidin2yl)3phenylprop2enamide
(E)N(5(4CHLOROPHENYL)7(4FLUOROPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)3PHENYLPROP2ENAMIDE
840456204
C1=CC=C(C=C1)C=CC(=O)NC2=NC3=NC(=CC(N3N2)C4=CC=C(C=C4)F)C5=CC=C(C=C5)Cl
InChI=1SC26H19ClFN5Oc272011718(81220)221623(1991321(28)141019)3326(2922)3125(3233)3024(34)156174213517h11623H(H22930313234)b156+
MFCD18166550
O=C(Nc1nn2c(=NC(=CC2c2ccc(cc2)F)c2ccc(cc2)Cl)(nH)1)C=Cc1ccccc1
ZINC000002256451
ZINC000002256453
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