Vitas-M small molecule compound
2-(2-amino-3-cyano-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-4-yl)phenyl morpholine-4-carboxylate
Catalog ID
STK765477
SMILES N#CC1=C(N)Oc2c(C1c1ccccc1OC(=O)N1CCOCC1)c(=O)oc(c2)C
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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 C21H19N3O6 MW 409.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O6/c1-12-10-16-18(20(25)28-12)17(14(11-22)19(23)29-16)13-4-2-3-5-15(13)30-21(26)24-6-8-27-9-7-24/h2-5,10,17H,6-9,23H2,1H3InChIKey
SZHXVXOCKSLHDI-UHFFFAOYSA-NSynonyms
(2(2AMINO3CYANO7METHYL5OXO4HPYRANO(32C)PYRAN4YL)PHENYL)MORPHOLINE4CARBOXYLATE
2(2amino3cyano7methyl5oxo4H5Hpyrano(43b)pyran4yl)phenylmorpholine4carboxylate
CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3OC(=O)N4CCOCC4)C(=O)O1
InChI=1SC21H19N3O6c112101618(20(25)2812)17(14(1122)19(23)2916)13423515(13)3021(26)2468279724h251017H6923H21H3
MFCD03035624
ZINC000000718359
ZINC000000718360
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