Vitas-M small molecule compound

ethyl 6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate

Catalog ID
STK538997
SMILES CCOC(=O)C1=C(OC(=C(C1c1ccc(cc1)C(C)(C)C)C#N)N)c1ccccc1

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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 C25H26N2O3 MW 402.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O3/c1-5-29-24(28)21-20(16-11-13-18(14-12-16)25(2,3)4)19(15-26)23(27)30-22(21)17-9-7-6-8-10-17/h6-14,20H,5,27H2,1-4H3
InChIKey
RPTVLGQMLWRKSY-UHFFFAOYSA-N
Synonyms
354555-85-4
354555854
CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)C(C)(C)C)C#N)N)C3=CC=CC=C3
ETHYL6AMINO4(4(TERTBUTYL)PHENYL)5CYANO2PHENYL4HPYRAN3CARBOXYLATE
ethyl6amino4(4tertbutylphenyl)5cyano2phenyl4Hpyran3carboxylate
InChI=1SC25H26N2O3c152924(28)2120(16111318(141216)25(23)4)19(1526)23(27)3022(21)1797681017h61420H527H214H3
MFCD02168161
ZINC000000662366
ZINC000000662368

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Available files

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