Vitas-M small molecule compound

ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate

Catalog ID
STK833433
SMILES CCOC(=O)C1=C(CC(=O)OCC)OC(=C(C1c1ccc(cc1)OC)C#N)N

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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 C20H22N2O6 MW 386.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O6/c1-4-26-16(23)10-15-18(20(24)27-5-2)17(14(11-21)19(22)28-15)12-6-8-13(25-3)9-7-12/h6-9,17H,4-5,10,22H2,1-3H3
InChIKey
DSBUPDGXBBZTIR-UHFFFAOYSA-N
Synonyms
304873-13-0
304873130
CCOC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(C=C2)OC)C(=O)OCC
ETHYL(4S)6AMINO5CYANO2(2ETHOXY2OXOETHYL)4(4METHOXYPHENYL)4HPYRAN3CARBOXYLATE
ETHYL2(6AMINO5CYANO3(ETHOXYCARBONYL)4(4METHOXYPHENYL)4HPYRAN2YL)ACETATE
ethyl6amino5cyano2(2ethoxy2oxoethyl)4(4methoxyphenyl)4Hpyran3carboxylate
InChI=1SC20H22N2O6c142616(23)101518(20(24)2752)17(14(1121)19(22)2815)126813(253)9712h6917H451022H213H3
MFCD01471315
ZINC000001206415
ZINC000001206417

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Available files

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