Vitas-M small molecule compound
N-[(1Z)-3-[(2E)-2-(4-tert-butylbenzylidene)hydrazinyl]-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Catalog ID
STK979736
SMILES O=C(/C(=C/c1ccc(cc1)[N+](=O)[O-])/NC(=O)c1ccccc1)N/N=C/c1ccc(cc1)C(C)(C)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 C27H26N4O4 MW 470.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4/c1-27(2,3)22-13-9-20(10-14-22)18-28-30-26(33)24(29-25(32)21-7-5-4-6-8-21)17-19-11-15-23(16-12-19)31(34)35/h4-18H,1-3H3,(H,29,32)(H,30,33)/b24-17-,28-18+InChIKey
IODSNZKTFZJZKL-WTIJGKOKSA-NSynonyms
CC(C)(C)C1=CC=C(C=C1)C=NNC(=O)C(=CC2=CC=C(C=C2)(N+)(=O)(O))NC(=O)C3=CC=CC=C3
InChI=1SC27H26N4O4c127(23)2213920(101422)18283026(33)24(2925(32)217546821)1719111523(161219)31(34)35h418H13H3(H2932)(H3033)b24172818+
MFCD04230000
N((1Z)3((2E)2(4tertbutylbenzylidene)hydrazinyl)1(4nitrophenyl)3oxoprop1en2yl)benzamide
N((Z)3((2E)2((4TERTBUTYLPHENYL)METHYLIDENE)HYDRAZINYL)1(4NITROPHENYL)3OXOPROP1EN2YL)BENZAMIDE
O=C(C(=Cc1ccc(cc1)(N+)(=O)(O))NC(=O)c1ccccc1)NN=Cc1ccc(cc1)C(C)(C)C
ZINC000002756686
ZINC33450454
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