Vitas-M small molecule compound
2-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl 2-bromobenzoate
Catalog ID
STK710225
SMILES CC1=NN(C(=O)/C/1=C/c1ccccc1OC(=O)c1ccccc1Br)c1ccccc1
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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 C24H17BrN2O3 MW 461.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17BrN2O3/c1-16-20(23(28)27(26-16)18-10-3-2-4-11-18)15-17-9-5-8-14-22(17)30-24(29)19-12-6-7-13-21(19)25/h2-15H,1H3/b20-15+InChIKey
LSMVRAPYHRKNJV-HMMYKYKNSA-NSynonyms
(2((E)(3METHYL5OXO1PHENYLPYRAZOL4YLIDENE)METHYL)PHENYL)2BROMOBENZOATE
2((E)(3methyl5oxo1phenyl15dihydro4Hpyrazol4ylidene)methyl)phenyl2bromobenzoate
CC1=NN(C(=O)C1=Cc1ccccc1OC(=O)c1ccccc1Br)c1ccccc1
CC1=NN(C(=O)C1=CC2=CC=CC=C2OC(=O)C3=CC=CC=C3Br)C4=CC=CC=C4
InChI=1SC24H17BrN2O3c11620(23(28)27(2616)18103241118)15179581422(17)3024(29)1912671321(19)25h215H1H3b2015+
MFCD01422648
ZINC000100088354
ZINC100088354
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