Vitas-M small molecule compound
2-[4-(difluoromethoxy)-3-methoxyphenyl]-7-methyl-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL178770
SMILES COc1cc(ccc1OC(F)F)c1nn2c(n1)c1sc3c(c1nc2)c(C)cc(n3)C(F)(F)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 C20H12F5N5O2S MW 481.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12F5N5O2S/c1-8-5-12(20(23,24)25)27-18-13(8)14-15(33-18)17-28-16(29-30(17)7-26-14)9-3-4-10(32-19(21)22)11(6-9)31-2/h3-7,19H,1-2H3InChIKey
AVVOJKTZFLJCRP-UHFFFAOYSA-NSynonyms
866818-91-92(4(difluoromethoxy)3methoxyphenyl)7methyl9(trifluoromethyl)pyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
866818919
CC1=CC(=NC2=C1C3=C(S2)C4=NC(=NN4C=N3)C5=CC(=C(C=C5)OC(F)F)OC)C(F)(F)F
InChI=1SC20H12F5N5O2Sc18512(20(2324)25)271813(8)1415(3318)172816(2930(17)72614)93410(3219(21)22)11(69)312h3719H12H3
MFCD07434029
ZINC000013643719
ZINC13643719
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