Vitas-M small molecule compound
2-amino-4-{4-methoxy-3-[(pentafluorophenoxy)methyl]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK959515
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)COc1c(F)c(F)c(c(c1F)F)F)OC)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 C24H17F5N2O4 MW 492.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17F5N2O4/c1-33-14-6-5-10(16-12(8-30)24(31)35-15-4-2-3-13(32)17(15)16)7-11(14)9-34-23-21(28)19(26)18(25)20(27)22(23)29/h5-7,16H,2-4,9,31H2,1H3InChIKey
QFHMBGFOSGPHHF-UHFFFAOYSA-NSynonyms
514816-49-02amino4(4methoxy3((23456pentafluorophenoxy)methyl)phenyl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(4methoxy3((pentafluorophenoxy)methyl)phenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
514816490
COC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)COC4=C(C(=C(C(=C4F)F)F)F)F
InChI=1SC24H17F5N2O4c133146510(1612(830)24(31)351542313(32)17(15)16)711(14)9342321(28)19(26)18(25)20(27)22(23)29h5716H24931H21H3
MFCD02175328
ZINC000002114939
ZINC000002114940
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