Vitas-M small molecule compound
2-{5-[(4-tert-butylphenoxy)methyl]furan-2-yl}-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL174325
SMILES FC(c1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)c1ccc(o1)COc1ccc(cc1)C(C)(C)C)F
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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 C27H23F2N5O2S MW 519.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23F2N5O2S/c1-14-11-18(23(28)29)31-26-20(14)21-22(37-26)25-32-24(33-34(25)13-30-21)19-10-9-17(36-19)12-35-16-7-5-15(6-8-16)27(2,3)4/h5-11,13,23H,12H2,1-4H3InChIKey
ILUNMVGVCJVJIS-UHFFFAOYSA-NSynonyms
881478-12-22(5((4tertbutylphenoxy)methyl)furan2yl)9(difluoromethyl)7methylpyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
881478122
CC1=CC(=NC2=C1C3=C(S2)C4=NC(=NN4C=N3)C5=CC=C(O5)COC6=CC=C(C=C6)C(C)(C)C)C(F)F
InChI=1SC27H23F2N5O2Sc1141118(23(28)29)312620(14)2122(3726)253224(3334(25)133021)1910917(3619)1235167515(6816)27(23)4h5111323H12H214H3
MFCD08554116
ZINC000013644066
ZINC13644066
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