Vitas-M small molecule compound
2,3-dimethoxy-6-[(E)-{2-[({N-[(4-nitrophenyl)carbonyl]glycyl}amino)acetyl]hydrazinylidene}methyl]benzoic acid
Catalog ID
STK526614
SMILES COc1ccc(c(c1OC)C(=O)O)/C=N/NC(=O)CNC(=O)CNC(=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 C21H21N5O9 MW 487.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O9/c1-34-15-8-5-13(18(21(30)31)19(15)35-2)9-24-25-17(28)11-22-16(27)10-23-20(29)12-3-6-14(7-4-12)26(32)33/h3-9H,10-11H2,1-2H3,(H,22,27)(H,23,29)(H,25,28)(H,30,31)/b24-9+InChIKey
ISESDVHAAZPRPQ-PGGKNCGUSA-NSynonyms
373618-33-8(E)23dimethoxy6((2(2(2(4nitrobenzamido)acetamido)acetyl)hydrazono)methyl)benzoicacid
23dimethoxy6((E)((2((2((4nitrobenzoyl)amino)acetyl)amino)acetyl)hydrazinylidene)methyl)benzoicacid
23dimethoxy6((E)(2(((N((4nitrophenyl)carbonyl)glycyl)amino)acetyl)hydrazinylidene)methyl)benzoicacid
373618338
COC1=C(C(=C(C=C1)C=NNC(=O)CNC(=O)CNC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)O)OC
COc1ccc(c(c1OC)C(=O)O)C=NNC(=O)CNC(=O)CNC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H21N5O9c134158513(18(21(30)31)19(15)352)9242517(28)112216(27)102320(29)123614(7412)26(32)33h39H1011H212H3(H2227)(H2329)(H2528)(H3031)b249+
MFCD01949177
ZINC000008771672
ZINC33701627
Check stock
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Check stock on Vitas-MAvailable files
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