Vitas-M small molecule compound
2-methyl-3-nitro-N-(4-{4-[(2E)-3-phenylprop-2-enoyl]piperazin-1-yl}phenyl)benzamide
Catalog ID
STK243718
SMILES O=C(N1CCN(CC1)c1ccc(cc1)NC(=O)c1cccc(c1C)[N+](=O)[O-])/C=C/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 C27H26N4O4 MW 470.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4/c1-20-24(8-5-9-25(20)31(34)35)27(33)28-22-11-13-23(14-12-22)29-16-18-30(19-17-29)26(32)15-10-21-6-3-2-4-7-21/h2-15H,16-19H2,1H3,(H,28,33)/b15-10+InChIKey
UQVGVFNQPGYPPB-XNTDXEJSSA-NSynonyms
2methyl3nitroN(4(4((2E)3phenylprop2enoyl)piperazin1yl)phenyl)benzamide
2methyl3nitroN(4(4((E)3phenylprop2enoyl)piperazin1yl)phenyl)benzamide
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4
InChI=1SC27H26N4O4c12024(85925(20)31(34)35)27(33)2822111323(141222)29161830(191729)26(32)1510216324721h215H1619H21H3(H2833)b1510+
MFCD07628465
O=C(N1CCN(CC1)c1ccc(cc1)NC(=O)c1cccc(c1C)(N+)(=O)(O))C=Cc1ccccc1
ZINC000009192659
ZINC09192659
ZINC9192659
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