Vitas-M small molecule compound

benzyl 6-amino-5-cyano-4-(4-ethylphenyl)-2-methyl-4H-pyran-3-carboxylate

Catalog ID
STK749159
SMILES CCc1ccc(cc1)C1C(=C(C)OC(=C1C#N)N)C(=O)OCc1ccccc1

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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 C23H22N2O3 MW 374.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O3/c1-3-16-9-11-18(12-10-16)21-19(13-24)22(25)28-15(2)20(21)23(26)27-14-17-7-5-4-6-8-17/h4-12,21H,3,14,25H2,1-2H3
InChIKey
IUCWMOPKDOOUHX-UHFFFAOYSA-N
Synonyms
304872-77-3
304872773
benzyl6amino5cyano4(4ethylphenyl)2methyl4Hpyran3carboxylate
CCC1=CC=C(C=C1)C2C(=C(OC(=C2C(=O)OCC3=CC=CC=C3)C)N)C#N
InChI=1SC23H22N2O3c131691118(121016)2119(1324)22(25)2815(2)20(21)23(26)2714177546817h41221H31425H212H3
MFCD00744596
PHENYLMETHYL6AMINO5CYANO4(4ETHYLPHENYL)2METHYL4HPYRAN3CARBOXYLATE
ZINC000000705958
ZINC000000705959

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Available files

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