Vitas-M small molecule compound
2-[3-(4-methoxyphenyl)-1H-pyrazol-4-yl]-9-methyl-7-(trifluoromethyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Catalog ID
STK302928
SMILES COc1ccc(cc1)c1n[nH]cc1C1NC(=O)c2c(N1)c1c(C)cc(nc1s2)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 C21H16F3N5O2S MW 459.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F3N5O2S/c1-9-7-13(21(22,23)24)26-20-14(9)16-17(32-20)19(30)28-18(27-16)12-8-25-29-15(12)10-3-5-11(31-2)6-4-10/h3-8,18,27H,1-2H3,(H,25,29)(H,28,30)InChIKey
FVYLQOGSUFQRTN-UHFFFAOYSA-NSynonyms
1005671-27-11005671271
2(3(4methoxyphenyl)1Hpyrazol4yl)9methyl7(trifluoromethyl)23dihydropyrido(3245)thieno(32d)pyrimidin4(1H)one
2(5(4methoxyphenyl)1Hpyrazol4yl)9methyl7(trifluoromethyl)23dihydro1Hpyrido(23)thieno(24d)pyrimidin4one
CC1=CC(=NC2=C1C3=C(S2)C(=O)NC(N3)C4=C(NN=C4)C5=CC=C(C=C5)OC)C(F)(F)F
COc1ccc(cc1)c1n(nH)cc1C1NC(=O)c2c(N1)c1c(C)cc(nc1s2)C(F)(F)F
InChI=1SC21H16F3N5O2Sc19713(21(2223)24)262014(9)1617(3220)19(30)2818(2716)128252915(12)103511(312)6410h381827H12H3(H2529)(H2830)
MFCD04048823
ZINC000013958167
ZINC000013958169
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