Vitas-M small molecule compound

methyl 4-{[3,5-bis(3,4-dimethoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate

Catalog ID
STL413813
SMILES COC(=O)c1ccc(cc1)Cn1nc(cc1c1ccc(c(c1)OC)OC)c1ccc(c(c1)OC)OC

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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 C28H28N2O6 MW 488.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O6/c1-32-24-12-10-20(14-26(24)34-3)22-16-23(21-11-13-25(33-2)27(15-21)35-4)30(29-22)17-18-6-8-19(9-7-18)28(31)36-5/h6-16H,17H2,1-5H3
InChIKey
RWQMCJXZPCXSBW-UHFFFAOYSA-N
Synonyms
1006347-07-4
1006347074
COC1=C(C=C(C=C1)C2=CC(=NN2CC3=CC=C(C=C3)C(=O)OC)C4=CC(=C(C=C4)OC)OC)OC
InChI=1SC28H28N2O6c13224121020(1426(24)343)221623(21111325(332)27(1521)354)30(2922)17186819(9718)28(31)365h616H17H215H3
methyl4((35bis(34dimethoxyphenyl)1Hpyrazol1yl)methyl)benzoate
methyl4((35bis(34dimethoxyphenyl)pyrazol1yl)methyl)benzoate
MFCD08551800
ZINC000022746388
ZINC22746388

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Available files

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