Vitas-M small molecule compound

(4E)-4-(3,5-dibromo-4-hydroxybenzylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STL406890
SMILES OC1=NN(C(=O)/C/1=C/c1cc(Br)c(c(c1)Br)O)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 C16H10Br2N2O3 MW 438.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10Br2N2O3/c17-12-7-9(8-13(18)14(12)21)6-11-15(22)19-20(16(11)23)10-4-2-1-3-5-10/h1-8,21H,(H,19,22)/b11-6+
InChIKey
XFCYMKYZBASCEO-IZZDOVSWSA-N
Synonyms

(4E)4((35DIBROMO4HYDROXYPHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(35dibromo4hydroxybenzylidene)5hydroxy2phenyl24dihydro3Hpyrazol3one
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Br)O)Br)C(=O)N2
InChI=1SC16H10Br2N2O3c171279(813(18)14(12)21)61115(22)1920(16(11)23)104213510h1821H(H1922)b116+
MFCD07565917
OC1=NN(C(=O)C1=Cc1cc(Br)c(c(c1)Br)O)c1ccccc1
ZINC000008660998
ZINC08660998
ZINC8660998

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Available files

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