Vitas-M small molecule compound
2-methoxy-4-{(E)-[2-({4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)hydrazinylidene]methyl}phenyl 2-methyl-3-nitrobenzoate
Catalog ID
STL052247
SMILES COc1cc(/C=N/NC(=O)c2ccc(cc2)Cn2nc(cc2C)[N+](=O)[O-])ccc1OC(=O)c1cccc(c1C)[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 C28H24N6O8 MW 572.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N6O8/c1-17-13-26(34(39)40)31-32(17)16-19-7-10-21(11-8-19)27(35)30-29-15-20-9-12-24(25(14-20)41-3)42-28(36)22-5-4-6-23(18(22)2)33(37)38/h4-15H,16H2,1-3H3,(H,30,35)/b29-15+InChIKey
QJFDKQNPMCWBBZ-WKULSOCRSA-NSynonyms
(2methoxy4((E)((4((5methyl3nitropyrazol1yl)methyl)benzoyl)hydrazinylidene)methyl)phenyl)2methyl3nitrobenzoate
(E)2methoxy4((2(4((5methyl3nitro1Hpyrazol1yl)methyl)benzoyl)hydrazono)methyl)phenyl2methyl3nitrobenzoate
2methoxy4((E)(2((4((5methyl3nitro1Hpyrazol1yl)methyl)phenyl)carbonyl)hydrazinylidene)methyl)phenyl2methyl3nitrobenzoate
CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)NN=CC3=CC(=C(C=C3)OC(=O)C4=C(C(=CC=C4)(N+)(=O)(O))C)OC)(N+)(=O)(O)
COc1cc(C=NNC(=O)c2ccc(cc2)Cn2nc(cc2C)(N+)(=O)(O))ccc1OC(=O)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC28H24N6O8c1171326(34(39)40)3132(17)161971021(11819)27(35)3029152091224(25(1420)413)4228(36)2254623(18(22)2)33(37)38h415H16H213H3(H3035)b2915+
MFCD03328055
ZINC000001875299
ZINC103121097
Check stock
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Check stock on Vitas-MAvailable files
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