Vitas-M small molecule compound
(5Z)-2,6-dihydroxy-5-{[1-(4-nitrophenyl)-2,5-diphenyl-1H-pyrrol-3-yl]methylidene}pyrimidin-4(5H)-one
Catalog ID
STK853981
SMILES OC1=NC(=O)/C(=C\c2cc(n(c2c2ccccc2)c2ccc(cc2)[N+](=O)[O-])c2ccccc2)/C(=N1)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 C27H18N4O5 MW 478.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N4O5/c32-25-22(26(33)29-27(34)28-25)15-19-16-23(17-7-3-1-4-8-17)30(24(19)18-9-5-2-6-10-18)20-11-13-21(14-12-20)31(35)36/h1-16H,(H2,28,29,32,33,34)InChIKey
CIZKJZBRRSGRND-UHFFFAOYSA-NSynonyms
(5Z)26dihydroxy5((1(4nitrophenyl)25diphenyl1Hpyrrol3yl)methylidene)pyrimidin4(5H)one
5((1(4NITROPHENYL)25DIPHENYLPYRROL3YL)METHYLIDENE)13DIAZINANE246TRIONE
C1=CC=C(C=C1)C2=CC(=C(N2C3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=C4)C=C5C(=O)NC(=O)NC5=O
InChI=1SC27H18N4O5c322522(26(33)2927(34)2825)15191623(177314817)30(24(19)1895261018)20111321(141220)31(35)36h116H(H22829323334)
MFCD08736125
OC1=NC(=O)C(=Cc2cc(n(c2c2ccccc2)c2ccc(cc2)(N+)(=O)(O))c2ccccc2)C(=N1)O
ZINC000008743402
ZINC8743402
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