Vitas-M small molecule compound

methyl 6-amino-5-cyano-2-(2-methoxy-2-oxoethyl)-4-(3-methoxy-4-propoxyphenyl)-4H-pyran-3-carboxylate

Catalog ID
STK092085
SMILES CCCOc1ccc(cc1OC)C1C(=C(N)OC(=C1C(=O)OC)CC(=O)OC)C#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 C21H24N2O7 MW 416.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O7/c1-5-8-29-14-7-6-12(9-15(14)26-2)18-13(11-22)20(23)30-16(10-17(24)27-3)19(18)21(25)28-4/h6-7,9,18H,5,8,10,23H2,1-4H3
InChIKey
LGFCZHSGDZQWAF-UHFFFAOYSA-N
Synonyms
364626-92-6
364626926
CCCOC1=C(C=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CC(=O)OC)N)C#N)OC
CCCOc1ccc(cc1OC)C1C(=C(N)OC(=C1C(=O)OC)CC(=O)OC)C#N
InChI=1SC21H24N2O7c15829147612(915(14)262)1813(1122)20(23)3016(1017(24)273)19(18)21(25)284h67918H581023H214H3
METHYL6AMINO5CYANO2(2METHOXY2OXOETHYL)4(3METHOXY4PROPOXYPHENYL)4HPYRAN3CARBOXYLATE
MFCD01853245
STK092085
ZINC000002266891
ZINC000002266892

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Available files

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