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 4-chlorobenzoate
Catalog ID
STL041080
SMILES COc1cc(/C=N/NC(=O)c2ccc(cc2)Cn2nc(cc2C)[N+](=O)[O-])ccc1OC(=O)c1ccc(cc1)Cl
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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 C27H22ClN5O6 MW 547.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN5O6/c1-17-13-25(33(36)37)31-32(17)16-18-3-6-20(7-4-18)26(34)30-29-15-19-5-12-23(24(14-19)38-2)39-27(35)21-8-10-22(28)11-9-21/h3-15H,16H2,1-2H3,(H,30,34)/b29-15+InChIKey
YTKDYWUQFCWNMV-WKULSOCRSA-NSynonyms
1006504-60-4(2METHOXY4((E)((4((5METHYL3NITROPYRAZOL1YL)METHYL)BENZOYL)HYDRAZINYLIDENE)METHYL)PHENYL)4CHLOROBENZOATE
(E)2methoxy4((2(4((5methyl3nitro1Hpyrazol1yl)methyl)benzoyl)hydrazono)methyl)phenyl4chlorobenzoate
1006504604
2methoxy4((E)(2((4((5methyl3nitro1Hpyrazol1yl)methyl)phenyl)carbonyl)hydrazinylidene)methyl)phenyl4chlorobenzoate
CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)NN=CC3=CC(=C(C=C3)OC(=O)C4=CC=C(C=C4)Cl)OC)(N+)(=O)(O)
COc1cc(C=NNC(=O)c2ccc(cc2)Cn2nc(cc2C)(N+)(=O)(O))ccc1OC(=O)c1ccc(cc1)Cl
InChI=1SC27H22ClN5O6c1171325(33(36)37)3132(17)16183620(7418)26(34)3029151951223(24(1419)382)3927(35)2181022(28)11921h315H16H212H3(H3034)b2915+
MFCD03328154
ZINC000001889955
ZINC103099548
Check stock
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Check stock on Vitas-MAvailable files
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