Vitas-M small molecule compound

ethyl 2-heptadecyl-3H-pyrazolo[1,5-a]benzimidazole-6-carboxylate

Catalog ID
STK366212
SMILES CCCCCCCCCCCCCCCCCC1=Nn2c(C1)nc1c2ccc(c1)C(=O)OCC

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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 C29H45N3O2 MW 467.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H45N3O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-23-28-30-26-22-24(29(33)34-4-2)20-21-27(26)32(28)31-25/h20-22H,3-19,23H2,1-2H3
InChIKey
POFXTYKXSXTEAT-UHFFFAOYSA-N
Synonyms
292841-32-8
292841328
CCCCCCCCCCCCCCCCCC1=NN2C(=NC3=C2C=CC(=C3)C(=O)OCC)C1
ETHYL2HEPTADECYL2PYRAZOLINO(15A)BENZIMIDAZOLE6CARBOXYLATE
ethyl2heptadecyl3Hpyrazolo(15a)benzimidazole6carboxylate
InChI=1SC29H45N3O2c13567891011121314151617181925232830262224(29(33)3442)202127(26)32(28)3125h2022H31923H212H3
MFCD00327316
ZINC000100878844
ZINC100878844

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.