Vitas-M small molecule compound

2-bromo-4-[(E)-{2-[(3-hydroxynaphthalen-2-yl)carbonyl]hydrazinylidene}methyl]-6-methoxyphenyl 4-methylbenzoate

Catalog ID
STK200211
SMILES COc1cc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc(c1OC(=O)c1ccc(cc1)C)Br

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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 C27H21BrN2O5 MW 533.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21BrN2O5/c1-16-7-9-18(10-8-16)27(33)35-25-22(28)11-17(12-24(25)34-2)15-29-30-26(32)21-13-19-5-3-4-6-20(19)14-23(21)31/h3-15,31H,1-2H3,(H,30,32)/b29-15+
InChIKey
WHMURGZDQMWTKV-WKULSOCRSA-N
Synonyms

(2bromo4((E)((3hydroxynaphthalene2carbonyl)hydrazinylidene)methyl)6methoxyphenyl)4methylbenzoate
2bromo4((E)(2((3hydroxynaphthalen2yl)carbonyl)hydrazinylidene)methyl)6methoxyphenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C=NNC(=O)C3=CC4=CC=CC=C4C=C3O)OC
COc1cc(C=NNC(=O)c2cc3ccccc3cc2O)cc(c1OC(=O)c1ccc(cc1)C)Br
InChI=1SC27H21BrN2O5c1167918(10816)27(33)352522(28)1117(1224(25)342)15293026(32)211319534620(19)1423(21)31h31531H12H3(H3032)b2915+
MFCD08680581
ZINC000097961098
ZINC101755073

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Available files

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