Vitas-M small molecule compound
7-(1,5-dimethyl-1H-pyrazol-4-yl)-2-[2-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]-9-(trifluoromethyl)pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL391019
SMILES [O-][N+](=O)c1cnn(c1)C(c1nn2c(n1)c1sc3c(c1nc2)c(cc(n3)C(F)(F)F)c1cnn(c1C)C)(C)C
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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 C22H17F3N10O2S MW 542.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N10O2S/c1-10-13(7-27-32(10)4)12-5-14(22(23,24)25)29-19-15(12)16-17(38-19)18-30-20(31-33(18)9-26-16)21(2,3)34-8-11(6-28-34)35(36)37/h5-9H,1-4H3InChIKey
BFFVEQSQNRFHFW-UHFFFAOYSA-NSynonyms
1007343-52-3(O)(N+)(=O)c1cnn(c1)C(c1nn2c(n1)c1sc3c(c1nc2)c(cc(n3)C(F)(F)F)c1cnn(c1C)C)(C)C
1007343523
7(15dimethyl1Hpyrazol4yl)2(2(4nitro1Hpyrazol1yl)propan2yl)9(trifluoromethyl)pyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CC1=C(C=NN1C)C2=CC(=NC3=C2C4=C(S3)C5=NC(=NN5C=N4)C(C)(C)N6C=C(C=N6)(N+)(=O)(O))C(F)(F)F
InChI=1SC22H17F3N10O2Sc11013(72732(10)4)12514(22(2324)25)291915(12)1617(3819)183020(3133(18)92616)21(23)34811(62834)35(36)37h59H14H3
MFCD08558635
ZINC000098046274
ZINC98046274
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