Vitas-M small molecule compound

1-(3-chloro-4-methylphenyl)-3,5-bis(3,4-dimethoxyphenyl)-4-ethyl-1H-pyrazole

Catalog ID
STL392550
SMILES COc1cc(ccc1OC)c1nn(c(c1CC)c1ccc(c(c1)OC)OC)c1ccc(c(c1)Cl)C

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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 C28H29ClN2O4 MW 493.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClN2O4/c1-7-21-27(18-9-12-23(32-3)25(14-18)34-5)30-31(20-11-8-17(2)22(29)16-20)28(21)19-10-13-24(33-4)26(15-19)35-6/h8-16H,7H2,1-6H3
InChIKey
JUIVUFNSEJXEBD-UHFFFAOYSA-N
Synonyms
1006324-72-6
1(3chloro4methylphenyl)35bis(34dimethoxyphenyl)4ethyl1Hpyrazole
1(3chloro4methylphenyl)35bis(34dimethoxyphenyl)4ethylpyrazole
1006324726
CCC1=C(N(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC(=C(C=C3)C)Cl)C4=CC(=C(C=C4)OC)OC
InChI=1SC28H29ClN2O4c172127(1891223(323)25(1418)345)3031(2011817(2)22(29)1620)28(21)19101324(334)26(1519)356h816H7H216H3
MFCD08552505
ZINC000022751358
ZINC22751358

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Available files

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