Vitas-M small molecule compound

(4Z)-4-{5-chloro-2-[2-(3-methoxyphenoxy)ethoxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK013412
SMILES COc1cccc(c1)OCCOc1ccc(cc1/C=C\1/C(=NN(C1=O)c1ccccc1)C)Cl

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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 C26H23ClN2O4 MW 462.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O4/c1-18-24(26(30)29(28-18)21-7-4-3-5-8-21)16-19-15-20(27)11-12-25(19)33-14-13-32-23-10-6-9-22(17-23)31-2/h3-12,15-17H,13-14H2,1-2H3/b24-16-
InChIKey
QERIBPBAGAXVGP-JLPGSUDCSA-N
Synonyms

(4Z)4((5CHLORO2(2(3METHOXYPHENOXY)ETHOXY)PHENYL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(4Z)4(5CHLORO2(2(3METHOXYPHENOXY)ETHOXY)BENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
CC1=NN(C(=O)C1=CC2=C(C=CC(=C2)Cl)OCCOC3=CC=CC(=C3)OC)C4=CC=CC=C4
COc1cccc(c1)OCCOc1ccc(cc1C=C1C(=NN(C1=O)c1ccccc1)C)Cl
InChI=1SC26H23ClN2O4c11824(26(30)29(2818)217435821)16191520(27)111225(19)3314133223106922(1723)312h3121517H1314H212H3b2416
MFCD02121207
STK013412
ZINC000008983811
ZINC08983811
ZINC8983811

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Available files

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