Vitas-M small molecule compound
4-hydroxy-6-(3-nitrophenyl)-5-(pyridin-3-ylcarbonyl)-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
Catalog ID
STL091008
SMILES O=C1NC(c2cccc(c2)[N+](=O)[O-])C(C(N1)(O)C(F)(F)F)C(=O)c1cccnc1
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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 C17H13F3N4O5 MW 410.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13F3N4O5/c18-17(19,20)16(27)12(14(25)10-4-2-6-21-8-10)13(22-15(26)23-16)9-3-1-5-11(7-9)24(28)29/h1-8,12-13,27H,(H2,22,23,26)InChIKey
DITNEJNVBANGNY-UHFFFAOYSA-NSynonyms
474260-66-7474260667
4HYDROXY5NICOTINOYL6(3NITROPHENYL)4(TRIFLUOROMETHYL)TETRAHYDROPYRIMIDIN2(1H)ONE
4hydroxy6(3nitrophenyl)5(pyridin3ylcarbonyl)4(trifluoromethyl)tetrahydropyrimidin2(1H)one
4HYDROXY6(3NITROPHENYL)5(PYRIDINE3CARBONYL)4(TRIFLUOROMETHYL)13DIAZINAN2ONE
C1=CC(=CC(=C1)(N+)(=O)(O))C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)C3=CN=CC=C3
InChI=1SC17H13F3N4O5c1817(1920)16(27)12(14(25)1042621810)13(2215(26)2316)931511(79)24(28)29h18121327H(H2222326)
MFCD02249979
O=C1NC(c2cccc(c2)(N+)(=O)(O))C(C(N1)(O)C(F)(F)F)C(=O)c1cccnc1
ZINC000001155320
ZINC000101882277
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