Vitas-M small molecule compound
(4Z)-4-[2-bromo-5-methoxy-4-(propan-2-yloxy)benzylidene]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK958752
SMILES COc1cc(/C=C\2/C(=NN(C2=O)c2ccc(cc2)C)C)c(cc1OC(C)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 C22H23BrN2O3 MW 443.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN2O3/c1-13(2)28-21-12-19(23)16(11-20(21)27-5)10-18-15(4)24-25(22(18)26)17-8-6-14(3)7-9-17/h6-13H,1-5H3/b18-10-InChIKey
CPRYREMEAKAQNP-ZDLGFXPLSA-NSynonyms
445284-95-7(4Z)4((2BROMO5METHOXY4PROPAN2YLOXYPHENYL)METHYLIDENE)5METHYL2(4METHYLPHENYL)PYRAZOL3ONE
(4Z)4(2bromo5methoxy4(propan2yloxy)benzylidene)5methyl2(4methylphenyl)24dihydro3Hpyrazol3one
4(2BROMO4ISOPROPOXY5METHOXYBENZYLIDENE)5METHYL2(4METHYLPHENYL)24DIHYDRO3HPYRAZOL3ONE
445284957
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3Br)OC(C)C)OC)C(=N2)C
COc1cc(C=C2C(=NN(C2=O)c2ccc(cc2)C)C)c(cc1OC(C)C)Br
InChI=1SC22H23BrN2O3c113(2)28211219(23)16(1120(21)275)101815(4)2425(22(18)26)178614(3)7917h613H15H3b1810
MFCD02371547
ZINC000008444180
ZINC08444180
ZINC8444180
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