Vitas-M small molecule compound
1-{5-(5-bromo-2-methoxyphenyl)-1-(4-methylphenyl)-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}ethanone
Catalog ID
STK510752
SMILES COc1ccc(cc1C1N(N=C(N1c1cccc(c1)C(F)(F)F)C(=O)C)c1ccc(cc1)C)Br
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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 C25H21BrF3N3O2 MW 532.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrF3N3O2/c1-15-7-10-19(11-8-15)32-24(21-14-18(26)9-12-22(21)34-3)31(23(30-32)16(2)33)20-6-4-5-17(13-20)25(27,28)29/h4-14,24H,1-3H3InChIKey
FXCJYFLONXLLNM-UHFFFAOYSA-NSynonyms
1(3(5BROMO2METHOXYPHENYL)2(4METHYLPHENYL)4(3(TRIFLUOROMETHYL)PHENYL)3H124TRIAZOL5YL)ETHANONE
1(5(5bromo2methoxyphenyl)1(4methylphenyl)4(3(trifluoromethyl)phenyl)45dihydro1H124triazol3yl)ethanone
3ACETYL5(5BROMO2METHOXYPHENYL)1(4METHYLPHENYL)4(3(TRIFLUOROMETHYL)PHENYL)124TRIAZOLINE
CC1=CC=C(C=C1)N2C(N(C(=N2)C(=O)C)C3=CC=CC(=C3)C(F)(F)F)C4=C(C=CC(=C4)Br)OC
InChI=1SC25H21BrF3N3O2c11571019(11815)3224(211418(26)91222(21)343)31(23(3032)16(2)33)2064517(1320)25(2728)29h41424H13H3
MFCD03549701
ZINC000100384383
ZINC000100384388
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