Vitas-M small molecule compound
2-amino-4-(4-butoxyphenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK044110
SMILES CCCCOc1ccc(cc1)C1C(=C(N)Oc2c1c(=O)oc(c2)C)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 C20H20N2O4 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4/c1-3-4-9-24-14-7-5-13(6-8-14)17-15(11-21)19(22)26-16-10-12(2)25-20(23)18(16)17/h5-8,10,17H,3-4,9,22H2,1-2H3InChIKey
GHEBQEPGZGYBCQ-UHFFFAOYSA-NSynonyms
315246-06-1(4R)2AMINO4(4BUTOXYPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
(4S)2AMINO4(4BUTOXYPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2amino4(4butoxyphenyl)7methyl5oxo45dihydropyrano(43b)pyran3carbonitrile
2AMINO4(4BUTOXYPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2AMINO4(4BUTOXYPHENYL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
315246061
CCCCOC1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)OC(=C3)C)N)C#N
CCCCOc1ccc(cc1)C1C(=C(N)Oc2c1c(=O)oc(c2)C)C#N
InChI=1SC20H20N2O4c134924147513(6814)1715(1121)19(22)26161012(2)2520(23)18(16)17h581017H34922H212H3
MFCD01541475
STK044110
ZINC000001894907
ZINC000001894910
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