Vitas-M small molecule compound
2-amino-4-[3-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL379701
SMILES C#CCOc1ccc(cc1OCC)C1C(=C(N)OC2=C1C(=O)CCC2)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 C21H20N2O4 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4/c1-3-10-26-16-9-8-13(11-18(16)25-4-2)19-14(12-22)21(23)27-17-7-5-6-15(24)20(17)19/h1,8-9,11,19H,4-7,10,23H2,2H3InChIKey
ACTSIWDLXYAYTB-UHFFFAOYSA-NSynonyms
2amino4(3ethoxy4(prop2yn1yloxy)phenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(3ethoxy4prop2ynoxyphenyl)5oxo4678tetrahydrochromene3carbonitrile
2AMINO4(3ETHOXY4PROP2YNYLOXYPHENYL)5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
CCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OCC#C
InChI=1SC21H20N2O4c131026169813(1118(16)2542)1914(1222)21(23)271775615(24)20(17)19h1891119H471023H22H3
MFCD05239464
ZINC000004570872
ZINC000004570876
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