Vitas-M small molecule compound

5-({4-[(1Z)-1-{2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)acetyl]hydrazinylidene}ethyl]phenoxy}methyl)furan-2-carboxylic acid

Catalog ID
STL402685
SMILES O=C(Cn1nc(c(c1)[N+](=O)[O-])C)N/N=C(\c1ccc(cc1)OCc1ccc(o1)C(=O)O)/C

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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 C20H19N5O7 MW 441.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O7/c1-12(21-22-19(26)10-24-9-17(25(29)30)13(2)23-24)14-3-5-15(6-4-14)31-11-16-7-8-18(32-16)20(27)28/h3-9H,10-11H2,1-2H3,(H,22,26)(H,27,28)/b21-12-
InChIKey
RBRHDPBIKXVKCM-MTJSOVHGSA-N
Synonyms
1005654-90-9
1005654909
5((4((1Z)1(2((3methyl4nitro1Hpyrazol1yl)acetyl)hydrazinylidene)ethyl)phenoxy)methyl)furan2carboxylicacid
5((4((1Z)1METHYL2(2(3METHYL4NITROPYRAZOLYL)ACETYLAMINO)2AZAVINYL)PHENOXY)METHYL)FURAN2CARBOXYLICACID
5((4((Z)CMETHYLN((2(3METHYL4NITROPYRAZOL1YL)ACETYL)AMINO)CARBONIMIDOYL)PHENOXY)METHYL)FURAN2CARBOXYLICACID
CC1=NN(C=C1(N+)(=O)(O))CC(=O)NN=C(C)C2=CC=C(C=C2)OCC3=CC=C(O3)C(=O)O
InChI=1SC20H19N5O7c112(212219(26)1024917(25(29)30)13(2)2324)143515(6414)3111167818(3216)20(27)28h39H1011H212H3(H2226)(H2728)b2112
MFCD06195425
O=C(Cn1nc(c(c1)(N+)(=O)(O))C)NN=C(c1ccc(cc1)OCc1ccc(o1)C(=O)O)C
ZINC000008816357
ZINC33522483

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Available files

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