Vitas-M small molecule compound
1-benzyl-4-hydroxy-7-(thiophen-2-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Catalog ID
STK564126
SMILES Oc1nc(=O)n(c2c1C(N=C(N2)c1cccs1)(C(F)(F)F)C(F)(F)F)Cc1ccccc1
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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 C19H12F6N4O2S MW 474.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F6N4O2S/c20-18(21,22)17(19(23,24)25)12-14(26-13(28-17)11-7-4-8-32-11)29(16(31)27-15(12)30)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,26,28)(H,27,30,31)InChIKey
HOCOKOKYRFWIAT-UHFFFAOYSA-NSynonyms
524053-39-21benzyl4hydroxy7(thiophen2yl)55bis(trifluoromethyl)58dihydropyrimido(45d)pyrimidin2(1H)one
524053392
C1=CC=C(C=C1)CN2C3=C(C(=O)NC2=O)C(N=C(N3)C4=CC=CS4)(C(F)(F)F)C(F)(F)F
InChI=1SC19H12F6N4O2Sc2018(2122)17(19(2324)25)1214(2613(2817)117483211)29(16(31)2715(12)30)9105213610h18H9H2(H2628)(H273031)
MFCD04073437
ZINC000008868024
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