Vitas-M small molecule compound
1-[5-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxyphenyl}-4-(4-ethoxyphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
Catalog ID
STK510716
SMILES CCOc1ccc(cc1)N1C(=NN(C1c1cc(Br)c(c(c1)OC)OCc1ccccc1Cl)c1ccccc1)C(=O)C
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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 C32H29BrClN3O4 MW 634.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29BrClN3O4/c1-4-40-26-16-14-24(15-17-26)36-31(21(2)38)35-37(25-11-6-5-7-12-25)32(36)23-18-27(33)30(29(19-23)39-3)41-20-22-10-8-9-13-28(22)34/h5-19,32H,4,20H2,1-3H3InChIKey
ZOTITMGIVVQLRJ-UHFFFAOYSA-NSynonyms
1(3(3BROMO4((2CHLOROPHENYL)METHOXY)5METHOXYPHENYL)4(4ETHOXYPHENYL)2PHENYL3H124TRIAZOL5YL)ETHANONE
1(5(3bromo4((2chlorobenzyl)oxy)5methoxyphenyl)4(4ethoxyphenyl)1phenyl45dihydro1H124triazol3yl)ethanone
CCOC1=CC=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=CC=C3)C4=CC(=C(C(=C4)Br)OCC5=CC=CC=C5Cl)OC
InChI=1SC32H29BrClN3O4c144026161424(151726)3631(21(2)38)3537(25116571225)32(36)231827(33)30(29(1923)393)41202210891328(22)34h51932H420H213H3
MFCD02615255
ZINC000150345342
ZINC000150345344
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