Vitas-M small molecule compound
2-amino-4-{5-[(2-nitrophenoxy)methyl]furan-2-yl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK961186
SMILES N#CC1=C(N)OC2=C(C1c1ccc(o1)COc1ccccc1[N+](=O)[O-])C(=O)CCC2
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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 C21H17N3O6 MW 407.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O6/c22-10-13-19(20-15(25)5-3-7-17(20)30-21(13)23)18-9-8-12(29-18)11-28-16-6-2-1-4-14(16)24(26)27/h1-2,4,6,8-9,19H,3,5,7,11,23H2InChIKey
ABISNGCKQLYCCQ-UHFFFAOYSA-NSynonyms
445242-24-02amino4(5((2nitrophenoxy)methyl)furan2yl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(5((2nitrophenoxy)methyl)furan2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
445242240
C1CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(O3)COC4=CC=CC=C4(N+)(=O)(O))C(=O)C1
InChI=1SC21H17N3O6c22101319(2015(25)53717(20)3021(13)23)189812(2918)112816621414(16)24(26)27h12468919H3571123H2
MFCD02244109
N#CC1=C(N)OC2=C(C1c1ccc(o1)COc1ccccc1(N+)(=O)(O))C(=O)CCC2
ZINC000002770094
ZINC000002770095
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