Vitas-M small molecule compound
2-methoxy-4-[(E)-{2-[(naphthalen-2-ylamino)acetyl]hydrazinylidene}methyl]phenyl 4-nitrobenzoate (non-preferred name)
Catalog ID
STK745971
SMILES COc1cc(/C=N/NC(=O)CNc2ccc3c(c2)cccc3)ccc1OC(=O)c1ccc(cc1)[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 C27H22N4O6 MW 498.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O6/c1-36-25-14-18(6-13-24(25)37-27(33)20-8-11-23(12-9-20)31(34)35)16-29-30-26(32)17-28-22-10-7-19-4-2-3-5-21(19)15-22/h2-16,28H,17H2,1H3,(H,30,32)/b29-16+InChIKey
NIZQXVYNQFSTBZ-MUFRIFMGSA-NSynonyms
(2methoxy4((E)((2(naphthalen2ylamino)acetyl)hydrazinylidene)methyl)phenyl)4nitrobenzoate
2methoxy4((E)(2((naphthalen2ylamino)acetyl)hydrazinylidene)methyl)phenyl4nitrobenzoate(nonpreferredname)
COC1=C(C=CC(=C1)C=NNC(=O)CNC2=CC3=CC=CC=C3C=C2)OC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
COc1cc(C=NNC(=O)CNc2ccc3c(c2)cccc3)ccc1OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC27H22N4O6c136251418(61324(25)3727(33)2081123(12920)31(34)35)16293026(32)17282210719423521(19)1522h21628H17H21H3(H3032)b2916+
MFCD00745692
ZINC000003090225
ZINC33246531
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