Vitas-M small molecule compound
N'-[(Z)-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methylidene]-4-methyl-3-nitrobenzohydrazide
Catalog ID
STK450887
SMILES COc1ccc(cc1Cn1ncc(c1)[N+](=O)[O-])/C=N\NC(=O)c1ccc(c(c1)[N+](=O)[O-])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 C20H18N6O6 MW 438.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O6/c1-13-3-5-15(8-18(13)26(30)31)20(27)23-21-9-14-4-6-19(32-2)16(7-14)11-24-12-17(10-22-24)25(28)29/h3-10,12H,11H2,1-2H3,(H,23,27)/b21-9-InChIKey
NXEKHTYCNOXIJE-NKVSQWTQSA-NSynonyms
3NITRON(3((4NITRO1HPYRAZOL1YL)METHYL)4METHOXYBENZYLIDENE)4METHYLBENZOHYDRAZIDE
CC1=C(C=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)OC)CN3C=C(C=N3)(N+)(=O)(O))(N+)(=O)(O)
COc1ccc(cc1Cn1ncc(c1)(N+)(=O)(O))C=NNC(=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC20H18N6O6c1133515(818(13)26(30)31)20(27)23219144619(322)16(714)11241217(102224)25(28)29h31012H11H212H3(H2327)b219
MFCD03784448
N((1Z)2(4METHOXY3((4NITROPYRAZOLYL)METHYL)PHENYL)1AZAVINYL)(4METHYL3NITROPHENYL)CARBOXAMIDE
N((Z)(4methoxy3((4nitro1Hpyrazol1yl)methyl)phenyl)methylidene)4methyl3nitrobenzohydrazide
N((Z)(4METHOXY3((4NITROPYRAZOL1YL)METHYL)PHENYL)METHYLIDENEAMINO)4METHYL3NITROBENZAMIDE
ZINC000032573530
ZINC20395820
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