Vitas-M small molecule compound
(5-ethylthiophen-2-yl)[7-(3-phenoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
Catalog ID
STL173411
SMILES CCc1ccc(s1)C(=O)C1=C(Nc2n(C1c1cccc(c1)Oc1ccccc1)ncn2)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 C25H19F3N4O2S MW 496.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19F3N4O2S/c1-2-18-11-12-19(35-18)22(33)20-21(32-24(29-14-30-32)31-23(20)25(26,27)28)15-7-6-10-17(13-15)34-16-8-4-3-5-9-16/h3-14,21H,2H2,1H3,(H,29,30,31)InChIKey
PFJXSVYUFOOZSQ-UHFFFAOYSA-NSynonyms
866815-17-0(5ethylthiophen2yl)(7(3phenoxyphenyl)5(trifluoromethyl)17dihydro(124)triazolo(15a)pyrimidin6yl)methanone
(5ethylthiophen2yl)(7(3phenoxyphenyl)5(trifluoromethyl)47dihydro(124)triazolo(15a)pyrimidin6yl)methanone
866815170
CCC1=CC=C(S1)C(=O)C2=C(N=C3N=CNN3C2C4=CC(=CC=C4)OC5=CC=CC=C5)C(F)(F)F
InChI=1SC25H19F3N4O2Sc1218111219(3518)22(33)2021(3224(29143032)3123(20)25(2627)28)15761017(1315)34168435916h31421H2H21H3(H293031)
MFCD06197270
ZINC000036611904
ZINC000036611905
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