Vitas-M small molecule compound
N'-{(2Z)-2-methyl-3-[4-(propan-2-yl)phenyl]prop-2-en-1-ylidene}-3,5-dinitrobenzohydrazide
Catalog ID
STK331865
SMILES C/C(=C/c1ccc(cc1)C(C)C)/C=N/NC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C20H20N4O5 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O5/c1-13(2)16-6-4-15(5-7-16)8-14(3)12-21-22-20(25)17-9-18(23(26)27)11-19(10-17)24(28)29/h4-13H,1-3H3,(H,22,25)/b14-8-,21-12?InChIKey
IZKSWEKIMAAJIO-PTSCDZKQSA-NSynonyms
CC(=Cc1ccc(cc1)C(C)C)C=NNC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
CC(C)C1=CC=C(C=C1)C=C(C)C=NNC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC20H20N4O5c113(2)166415(5716)814(3)12212220(25)17918(23(26)27)1119(1017)24(28)29h413H13H3(H2225)b1482112?
MFCD04003709
N(((Z)2methyl3(4propan2ylphenyl)prop2enylidene)amino)35dinitrobenzamide
N((2Z)2methyl3(4(propan2yl)phenyl)prop2en1ylidene)35dinitrobenzohydrazide
ZINC000018194688
ZINC18194688
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