Vitas-M small molecule compound
(5E)-6-hydroxy-3-(3-methylphenyl)-5-{4-[(5-nitropyridin-2-yl)oxy]benzylidene}pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK607764
SMILES Cc1cccc(c1)N1C(=O)N=C(/C(=C\c2ccc(cc2)Oc2ccc(cn2)[N+](=O)[O-])/C1=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 C23H16N4O6 MW 444.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N4O6/c1-14-3-2-4-16(11-14)26-22(29)19(21(28)25-23(26)30)12-15-5-8-18(9-6-15)33-20-10-7-17(13-24-20)27(31)32/h2-13H,1H3,(H,25,28,30)/b19-12+InChIKey
CZKCSHNWDVDXLK-XDHOZWIPSA-NSynonyms
(5E)1(3METHYLPHENYL)5((4(5NITROPYRIDIN2YL)OXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)6hydroxy3(3methylphenyl)5(4((5nitropyridin2yl)oxy)benzylidene)pyrimidine24(3H5H)dione
CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC=C(C=C3)OC4=NC=C(C=C4)(N+)(=O)(O))C(=O)NC2=O
Cc1cccc(c1)N1C(=O)N=C(C(=Cc2ccc(cc2)Oc2ccc(cn2)(N+)(=O)(O))C1=O)O
InChI=1SC23H16N4O6c11432416(1114)2622(29)19(21(28)2523(26)30)12155818(9615)332010717(132420)27(31)32h213H1H3(H252830)b1912+
MFCD08733841
ZINC000013785879
ZINC13785879
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