Vitas-M small molecule compound
5-methyl-2-(4-nitrophenyl)-4-{(E)-[(2-{4-[(2E)-3-(3-nitrophenyl)prop-2-enoyl]piperazin-1-yl}ethyl)imino]methyl}-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK010423
SMILES O=C(N1CCN(CC1)CC/N=C/c1c(C)[nH]n(c1=O)c1ccc(cc1)[N+](=O)[O-])/C=C/c1cccc(c1)[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 C26H27N7O6 MW 533.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N7O6/c1-19-24(26(35)31(28-19)21-6-8-22(9-7-21)32(36)37)18-27-11-12-29-13-15-30(16-14-29)25(34)10-5-20-3-2-4-23(17-20)33(38)39/h2-10,17-18,28H,11-16H2,1H3/b10-5+,27-18+InChIKey
JTKIHPSWWQMBIS-LCJMQTIFSA-NSynonyms
354993-47-8354993478
5methyl2(4nitrophenyl)4((E)((2(4((2E)3(3nitrophenyl)prop2enoyl)piperazin1yl)ethyl)imino)methyl)12dihydro3Hpyrazol3one
5methyl2(4nitrophenyl)4((E)((2(4((E)3(3nitrophenyl)acryloyl)piperazin1yl)ethyl)imino)methyl)1Hpyrazol3(2H)one
MFCD01953238
O=C(N1CCN(CC1)CCN=Cc1c(C)(nH)n(c1=O)c1ccc(cc1)(N+)(=O)(O))C=Cc1cccc(c1)(N+)(=O)(O)
STK010423
ZINC000100104977
Check stock
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Check stock on Vitas-MAvailable files
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