Vitas-M small molecule compound
6-(dimethylamino)-2-fluoro-3-[4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-5-(3-methoxyphenyl)-1H-imidazol-2-yl]benzonitrile
Catalog ID
STL559662
SMILES N#Cc1c(F)c(ccc1N(C)C)c1nc(c([nH]1)c1cccc(c1)OC)c1oc(C)cc(=O)c1O
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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 C25H21FN4O4 MW 460.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21FN4O4/c1-13-10-19(31)23(32)24(34-13)22-21(14-6-5-7-15(11-14)33-4)28-25(29-22)16-8-9-18(30(2)3)17(12-27)20(16)26/h5-11,32H,1-4H3,(H,28,29)InChIKey
NAAAWGOTYRKIAV-UHFFFAOYSA-NSynonyms
139029912
6(dimethylamino)2fluoro3(4(3hydroxy6methyl4oxo4Hpyran2yl)5(3methoxyphenyl)1Himidazol2yl)benzonitrile
6(dimethylamino)2fluoro3(5(3hydroxy6methyl4oxo4Hpyran2yl)4(3methoxyphenyl)1Himidazol2yl)benzonitrile
6(dimethylamino)2fluoro3(5(3hydroxy6methyl4oxopyran2yl)4(3methoxyphenyl)1Himidazol2yl)benzonitrile
InChI=1SC25H21FN4O4c1131019(31)23(32)24(3413)2221(1465715(1114)334)2825(2922)168918(30(2)3)17(1227)20(16)26h51132H14H3(H2829)
MFCD32221502
N#Cc1c(F)c(ccc1N(C)C)c1nc(c((nH)1)c1oc(C)cc(=O)c1O)c1cccc(c1)OC
ZINC001776111724
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