Vitas-M small molecule compound
2-{4-methoxy-3-[(2,2,2-trifluoroethoxy)methyl]phenyl}-9-methyl-7-(trifluoromethyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Catalog ID
STK302821
SMILES COc1ccc(cc1COCC(F)(F)F)C1NC(=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 C21H17F6N3O3S MW 505.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F6N3O3S/c1-9-5-13(21(25,26)27)28-19-14(9)15-16(34-19)18(31)30-17(29-15)10-3-4-12(32-2)11(6-10)7-33-8-20(22,23)24/h3-6,17,29H,7-8H2,1-2H3,(H,30,31)InChIKey
MGRDYGOUTULETI-UHFFFAOYSA-NSynonyms
677023-58-42(4methoxy3((222trifluoroethoxy)methyl)phenyl)9methyl7(trifluoromethyl)23dihydropyrido(3245)thieno(32d)pyrimidin4(1H)one
2(4methoxy3(222trifluoroethoxymethyl)phenyl)9methyl7(trifluoromethyl)23dihydro1Hpyrido(23)thieno(24d)pyrimidin4one
677023584
CC1=CC(=NC2=C1C3=C(S2)C(=O)NC(N3)C4=CC(=C(C=C4)OC)COCC(F)(F)F)C(F)(F)F
InChI=1SC21H17F6N3O3Sc19513(21(2526)27)281914(9)1516(3419)18(31)3017(2915)103412(322)11(610)733820(2223)24h361729H78H212H3(H3031)
MFCD04048826
ZINC000013958108
ZINC000013958109
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