Vitas-M small molecule compound

ethyl 5-cyano-2-methyl-4-[4-(propan-2-yl)phenyl]-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate

Catalog ID
STK783472
SMILES CCOC(=O)C1=C(C)OC(=C(C1c1ccc(cc1)C(C)C)C#N)n1cccc1

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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 C23H24N2O3 MW 376.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O3/c1-5-27-23(26)20-16(4)28-22(25-12-6-7-13-25)19(14-24)21(20)18-10-8-17(9-11-18)15(2)3/h6-13,15,21H,5H2,1-4H3
InChIKey
HTFXTOZTKSUDLL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)C(C)C)C#N)N3C=CC=C3)C
ethyl5cyano2methyl4(4(propan2yl)phenyl)6(1Hpyrrol1yl)4Hpyran3carboxylate
ETHYL5CYANO2METHYL4(4PROPAN2YLPHENYL)6PYRROL1YL4HPYRAN3CARBOXYLATE
InChI=1SC23H24N2O3c152723(26)2016(4)2822(2512671325)19(1424)21(20)1810817(91118)15(2)3h6131521H5H214H3
MFCD06618290
ZINC000004751315
ZINC000004751316

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Available files

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