Vitas-M small molecule compound
4-[(E)-2-(3-chloro-4,5-diethoxyphenyl)ethenyl]-6-(trifluoromethyl)pyrimidin-2(1H)-one
Catalog ID
STK393631
SMILES CCOc1cc(/C=C/c2nc(=O)[nH]c(c2)C(F)(F)F)cc(c1OCC)Cl
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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 C17H16ClF3N2O3 MW 388.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClF3N2O3/c1-3-25-13-8-10(7-12(18)15(13)26-4-2)5-6-11-9-14(17(19,20)21)23-16(24)22-11/h5-9H,3-4H2,1-2H3,(H,22,23,24)/b6-5+InChIKey
VMYUCDNRDGYDNM-AATRIKPKSA-NSynonyms
4((E)2(3CHLORO45DIETHOXYPHENYL)ETHENYL)6(TRIFLUOROMETHYL)1HPYRIMIDIN2ONE
4((E)2(3chloro45diethoxyphenyl)ethenyl)6(trifluoromethyl)pyrimidin2(1H)one
6((1E)2(3CHLORO45DIETHOXYPHENYL)VINYL)4(TRIFLUOROMETHYL)3HYDROPYRIMIDIN2ONE
CCOC1=C(C(=CC(=C1)C=CC2=NC(=O)NC(=C2)C(F)(F)F)Cl)OCC
CCOc1cc(C=Cc2nc(=O)(nH)c(c2)C(F)(F)F)cc(c1OCC)Cl
InChI=1SC17H16ClF3N2O3c132513810(712(18)15(13)2642)5611914(17(1920)21)2316(24)2211h59H34H212H3(H222324)b65+
MFCD02914804
ZINC000004113114
ZINC04113114
ZINC4113114
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