Vitas-M small molecule compound
7-(1,5-dimethyl-1H-pyrazol-4-yl)-2-[1-(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
STL391424
SMILES CC(c1nn2c(n1)c1sc3c(c1nc2)c(cc(n3)C(F)(F)F)c1cnn(c1C)C)Cn1ncc(c1)[N+](=O)[O-]
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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(7-33-8-12(5-28-33)35(36)37)19-30-20-18-17(26-9-34(20)31-19)16-13(14-6-27-32(3)11(14)2)4-15(22(23,24)25)29-21(16)38-18/h4-6,8-10H,7H2,1-3H3InChIKey
HENBZOQHJBAOGO-UHFFFAOYSA-NSynonyms
1007343-50-11007343501
7(15dimethyl1Hpyrazol4yl)2(1(4nitro1Hpyrazol1yl)propan2yl)9(trifluoromethyl)pyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CC(c1nn2c(n1)c1sc3c(c1nc2)c(cc(n3)C(F)(F)F)c1cnn(c1C)C)Cn1ncc(c1)(N+)(=O)(O)
CC1=C(C=NN1C)C2=CC(=NC3=C2C4=C(S3)C5=NC(=NN5C=N4)C(C)CN6C=C(C=N6)(N+)(=O)(O))C(F)(F)F
InChI=1SC22H17F3N10O2Sc110(733812(52833)35(36)37)1930201817(26934(20)3119)1613(1462732(3)11(14)2)415(22(2324)25)2921(16)3818h46810H7H213H3
MFCD08558540
ZINC000098046271
ZINC000098046272
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