Vitas-M small molecule compound
ethyl 4-({6-[(2E)-2-(2-nitrobenzylidene)hydrazinyl][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}amino)benzoate
Catalog ID
STK376427
SMILES CCOC(=O)c1ccc(cc1)Nc1nc2nonc2nc1N/N=C/c1ccccc1[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 C20H16N8O5 MW 448.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N8O5/c1-2-32-20(29)12-7-9-14(10-8-12)22-16-17(24-19-18(23-16)26-33-27-19)25-21-11-13-5-3-4-6-15(13)28(30)31/h3-11H,2H2,1H3,(H,22,23,26)(H,24,25,27)/b21-11+InChIKey
JCELZPSKEJJCRI-SRZZPIQSSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC2=NC3=NON=C3N=C2NN=CC4=CC=CC=C4(N+)(=O)(O)
CCOC(=O)c1ccc(cc1)Nc1nc2nonc2nc1NN=Cc1ccccc1(N+)(=O)(O)
ethyl4((5((2E)2((2nitrophenyl)methylidene)hydrazinyl)(125)oxadiazolo(34b)pyrazin6yl)amino)benzoate
ETHYL4((6(((1E)2(2NITROPHENYL)1AZAVINYL)AMINO)125OXADIAZOLO(34E)PYRAZIN5YL)AMINO)BENZOATE
ethyl4((6((2E)2(2nitrobenzylidene)hydrazinyl)(125)oxadiazolo(34b)pyrazin5yl)amino)benzoate
InChI=1SC20H16N8O5c123220(29)127914(10812)221617(241918(2316)26332719)25211113534615(13)28(30)31h311H2H21H3(H222326)(H242527)b2111+
MFCD01032583
ZINC000004045970
ZINC33921907
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