Vitas-M small molecule compound
(5E)-1-(1,3-benzodioxol-5-yl)-5-(2-chloro-5-nitrobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK362817
SMILES O=C1NC(=O)N(C(=O)/C/1=C/c1cc(ccc1Cl)[N+](=O)[O-])c1ccc2c(c1)OCO2
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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 C18H10ClN3O7 MW 415.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H10ClN3O7/c19-13-3-1-11(22(26)27)5-9(13)6-12-16(23)20-18(25)21(17(12)24)10-2-4-14-15(7-10)29-8-28-14/h1-7H,8H2,(H,20,23,25)/b12-6+InChIKey
LJOCTDJMJVLBOX-WUXMJOGZSA-NSynonyms
(5E)1(13BENZODIOXOL5YL)5((2CHLORO5NITROPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(13BENZODIOXOL5YL)5(2CHLORO5NITROBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
1(2HBENZO(34D)13DIOXOLEN5YL)5((2CHLORO5NITROPHENYL)METHYLENE)13DIHYDROPYRIMIDINE246TRIONE
C1OC2=C(O1)C=C(C=C2)N3C(=O)C(=CC4=C(C=CC(=C4)(N+)(=O)(O))Cl)C(=O)NC3=O
InChI=1SC18H10ClN3O7c19133111(22(26)27)59(13)61216(23)2018(25)21(17(12)24)10241415(710)2982814h17H8H2(H202325)b126+
MFCD02772643
O=C1NC(=O)N(C(=O)C1=Cc1cc(ccc1Cl)(N+)(=O)(O))c1ccc2c(c1)OCO2
ZINC000008861773
ZINC8861773
Check stock
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