Vitas-M small molecule compound
methyl (2E)-{2-[(4,6-dimethylpyrimidin-2-yl)amino]-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,5-dihydro-4H-imidazol-4-ylidene}ethanoate
Catalog ID
STK020753
SMILES COC(=O)/C=C\1/N=C(N(C1=O)c1cccc(c1)C(F)(F)F)Nc1nc(C)cc(n1)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 C19H16F3N5O3 MW 419.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16F3N5O3/c1-10-7-11(2)24-17(23-10)26-18-25-14(9-15(28)30-3)16(29)27(18)13-6-4-5-12(8-13)19(20,21)22/h4-9H,1-3H3,(H,23,24,25,26)/b14-9+InChIKey
WOKAXDDOFOHOCP-NTEUORMPSA-NSynonyms
(Z)methyl2(2((46dimethylpyrimidin2yl)amino)5oxo1(3(trifluoromethyl)phenyl)1Himidazol4(5H)ylidene)acetate
CC1=CC(=NC(=N1)NC2=NC(=CC(=O)OC)C(=O)N2C3=CC=CC(=C3)C(F)(F)F)C
COC(=O)C=C1N=C(N(C1=O)c1cccc(c1)C(F)(F)F)Nc1nc(C)cc(n1)C
InChI=1SC19H16F3N5O3c110711(2)2417(2310)26182514(915(28)303)16(29)27(18)1364512(813)19(2021)22h49H13H3(H23242526)b149+
METHYL(2E)(2((46DIMETHYLPYRIMIDIN2YL)AMINO)5OXO1(3(TRIFLUOROMETHYL)PHENYL)15DIHYDRO4HIMIDAZOL4YLIDENE)ETHANOATE
METHYL(2E)2(2((46DIMETHYLPYRIMIDIN2YL)AMINO)5OXO1(3(TRIFLUOROMETHYL)PHENYL)IMIDAZOL4YLIDENE)ACETATE
METHYL2(2((46DIMETHYLPYRIMIDIN2YL)AMINO)5OXO1(3(TRIFLUOROMETHYL)PHENYL)13DIAZOLIN4YLIDENE)ACETATE
MFCD03044650
STK020753
ZINC000017161395
ZINC17161395
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