Vitas-M small molecule compound
2-amino-4-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL379732
SMILES C#CCOc1ccc(cc1OC)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 C20H18N2O4 MW 350.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O4/c1-3-9-25-15-8-7-12(10-17(15)24-2)18-13(11-21)20(22)26-16-6-4-5-14(23)19(16)18/h1,7-8,10,18H,4-6,9,22H2,2H3InChIKey
IHMSYEYSDGOVPA-UHFFFAOYSA-NSynonyms
2amino4(3methoxy4(prop2yn1yloxy)phenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(3methoxy4prop2ynoxyphenyl)5oxo4678tetrahydrochromene3carbonitrile
2AMINO4(3METHOXY4PROP2YNYLOXYPHENYL)5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
COC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OCC#C
InChI=1SC20H18N2O4c13925158712(1017(15)242)1813(1121)20(22)261664514(23)19(16)18h1781018H46922H22H3
MFCD04151760
ZINC000002163683
ZINC000002163686
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