Vitas-M small molecule compound
2-{(2E)-2-[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
Catalog ID
STK006081
SMILES CC1=NN(C(=O)/C/1=N/Nc1ccccc1C(=O)O)c1ccc(cc1)[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 C17H13N5O5 MW 367.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O5/c1-10-15(19-18-14-5-3-2-4-13(14)17(24)25)16(23)21(20-10)11-6-8-12(9-7-11)22(26)27/h2-9,18H,1H3,(H,24,25)/b19-15+InChIKey
JWRBFFSZTUUWBN-XDJHFCHBSA-NSynonyms
2((2E)2(3METHYL1(4NITROPHENYL)5OXO15DIHYDRO4HPYRAZOL4YLIDENE)HYDRAZINYL)BENZOICACID
2((2E)2(3METHYL1(4NITROPHENYL)5OXOPYRAZOL4YLIDENE)HYDRAZINYL)BENZOICACID
CC1=NN(C(=O)C1=NNc1ccccc1C(=O)O)c1ccc(cc1)(N+)(=O)(O)
CC1=NN(C(=O)C1=NNC2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H13N5O5c11015(191814532413(14)17(24)25)16(23)21(2010)116812(9711)22(26)27h2918H1H3(H2425)b1915+
MFCD01418875
STK006081
ZINC000100149488
ZINC13574759
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