Vitas-M small molecule compound
(5Z)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-(3-ethoxy-4-hydroxy-5-nitrobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484429
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2cc(ccc2Cl)C(F)(F)F)cc(c1O)[N+](=O)[O-]
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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 C20H13ClF3N3O7 MW 499.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClF3N3O7/c1-2-34-15-7-9(6-14(16(15)28)27(32)33)5-11-17(29)25-19(31)26(18(11)30)13-8-10(20(22,23)24)3-4-12(13)21/h3-8,28H,2H2,1H3,(H,25,29,31)/b11-5-InChIKey
RZMZHPPEZHADQE-WZUFQYTHSA-NSynonyms
(5Z)1(2CHLORO5(TRIFLUOROMETHYL)PHENYL)5((3ETHOXY4HYDROXY5NITROPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(2chloro5(trifluoromethyl)phenyl)5(3ethoxy4hydroxy5nitrobenzylidene)pyrimidine246(1H3H5H)trione
1(2CHLORO5(TRIFLUOROMETHYL)PHENYL)5((5ETHOXY4HYDROXY3NITROPHENYL)METHYLENE)13DIHYDROPYRIMIDINE246TRIONE
CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C=C2C(=O)NC(=O)N(C2=O)C3=C(C=CC(=C3)C(F)(F)F)Cl
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2cc(ccc2Cl)C(F)(F)F)cc(c1O)(N+)(=O)(O)
InChI=1SC20H13ClF3N3O7c12341579(614(16(15)28)27(32)33)51117(29)2519(31)26(18(11)30)13810(20(2223)24)3412(13)21h3828H2H21H3(H252931)b115
MFCD02921417
ZINC000001178065
ZINC1178065
Check stock
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Check stock on Vitas-MAvailable files
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