Vitas-M small molecule compound
2-amino-4-(3-bromo-4-fluorophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK711786
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)Br)F)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 C16H12BrFN2O2 MW 363.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrFN2O2/c17-10-6-8(4-5-11(10)18)14-9(7-19)16(20)22-13-3-1-2-12(21)15(13)14/h4-6,14H,1-3,20H2InChIKey
KMFYRTSKIPUZBI-UHFFFAOYSA-NSynonyms
2amino4(3bromo4fluorophenyl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(3bromo4fluorophenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
C1CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)F)Br)C(=O)C1
InChI=1SC16H12BrFN2O2c171068(4511(10)18)149(719)16(20)221331212(21)15(13)14h4614H1320H2
MFCD00473273
ZINC000000705847
ZINC000000705848
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