Vitas-M small molecule compound
methyl 4-{[3,5-bis(3,4-dimethylphenyl)-4-methyl-1H-pyrazol-1-yl]methyl}benzoate
Catalog ID
STK314022
SMILES COC(=O)c1ccc(cc1)Cn1nc(c(c1c1ccc(c(c1)C)C)C)c1ccc(c(c1)C)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 C29H30N2O2 MW 438.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O2/c1-18-7-11-25(15-20(18)3)27-22(5)28(26-12-8-19(2)21(4)16-26)31(30-27)17-23-9-13-24(14-10-23)29(32)33-6/h7-16H,17H2,1-6H3InChIKey
PGWMDEHCKPEIJD-UHFFFAOYSA-NSynonyms
1006318-81-51006318815
CC1=C(C=C(C=C1)C2=C(C(=NN2CC3=CC=C(C=C3)C(=O)OC)C4=CC(=C(C=C4)C)C)C)C
InChI=1SC29H30N2O2c11871125(1520(18)3)2722(5)28(2612819(2)21(4)1626)31(3027)172391324(141023)29(32)336h716H17H216H3
methyl4((35bis(34dimethylphenyl)4methyl1Hpyrazol1yl)methyl)benzoate
methyl4((35bis(34dimethylphenyl)4methylpyrazol1yl)methyl)benzoate
MFCD08552034
ZINC000002733345
ZINC02733345
ZINC2733345
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Check stock on Vitas-MAvailable files
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