Vitas-M small molecule compound

N-(4-fluorophenyl)-2-{3-[(E)-2-(4-hydroxy-5-nitro-6-oxo-1,6-dihydropyrimidin-2-yl)ethenyl]-1H-indol-1-yl}acetamide

Catalog ID
STK212873
SMILES Fc1ccc(cc1)NC(=O)Cn1cc(c2c1cccc2)/C=C/c1nc(O)c(c(=O)[nH]1)[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 C22H16FN5O5 MW 449.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16FN5O5/c23-14-6-8-15(9-7-14)24-19(29)12-27-11-13(16-3-1-2-4-17(16)27)5-10-18-25-21(30)20(28(32)33)22(31)26-18/h1-11H,12H2,(H,24,29)(H2,25,26,30,31)/b10-5+
InChIKey
JGOKCGLWDMTTEI-BJMVGYQFSA-N
Synonyms

2(3((E)2(46DIHYDROXY5NITROPYRIMIDIN2YL)ETHENYL)1HINDOL1YL)N(4FLUOROPHENYL)ACETAMIDE
C1=CC=C2C(=C1)C(=CN2CC(=O)NC3=CC=C(C=C3)F)C=CC4=NC(=C(C(=O)N4)(N+)(=O)(O))O
Fc1ccc(cc1)NC(=O)Cn1cc(c2c1cccc2)C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O)
InChI=1SC22H16FN5O5c23146815(9714)2419(29)12271113(16312417(16)27)510182521(30)20(28(32)33)22(31)2618h111H12H2(H2429)(H225263031)b105+
MFCD05992061
N(4FLUOROPHENYL)2(3((E)2(4HYDROXY5NITRO6OXO16DIHYDROPYRIMIDIN2YL)ETHENYL)1HINDOL1YL)ACETAMIDE
N(4FLUOROPHENYL)2(3((E)2(4HYDROXY5NITRO6OXO1HPYRIMIDIN2YL)ETHENYL)INDOL1YL)ACETAMIDE
ZINC9234851

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Available files

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