Vitas-M small molecule compound
3-{(2E)-2-[3-(4-nitrophenyl)-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazinyl}benzoic acid
Catalog ID
STK055979
SMILES OC(=O)c1cccc(c1)N/N=C\1/C(=O)N(N=C1c1ccc(cc1)[N+](=O)[O-])c1ccccc1
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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 C22H15N5O5 MW 429.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15N5O5/c28-21-20(24-23-16-6-4-5-15(13-16)22(29)30)19(14-9-11-18(12-10-14)27(31)32)25-26(21)17-7-2-1-3-8-17/h1-13,23H,(H,29,30)/b24-20+InChIKey
WPNJRXRXHYBARM-HIXSDJFHSA-NSynonyms
3((2E)2(3(4NITROPHENYL)5OXO1PHENYL15DIHYDRO4HPYRAZOL4YLIDENE)HYDRAZINYL)BENZOICACID
3((2E)2(3(4NITROPHENYL)5OXO1PHENYLPYRAZOL4YLIDENE)HYDRAZINYL)BENZOICACID
C1=CC=C(C=C1)N2C(=O)C(=NNC3=CC=CC(=C3)C(=O)O)C(=N2)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC22H15N5O5c282120(24231664515(1316)22(29)30)19(1491118(121014)27(31)32)2526(21)177213817h11323H(H2930)b2420+
MFCD01418796
OC(=O)c1cccc(c1)NN=C1C(=O)N(N=C1c1ccc(cc1)(N+)(=O)(O))c1ccccc1
STK055979
ZINC000018115151
ZINC12275792
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