Vitas-M small molecule compound
5-benzyl-4-(3-ethoxy-4-hydroxyphenyl)-1-methyl-3-(4-methylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Catalog ID
STL214621
SMILES CCOc1cc(ccc1O)C1N(Cc2ccccc2)C(=O)c2c1c(nn2C)c1ccc(cc1)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 C28H27N3O3 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O3/c1-4-34-23-16-21(14-15-22(23)32)26-24-25(20-12-10-18(2)11-13-20)29-30(3)27(24)28(33)31(26)17-19-8-6-5-7-9-19/h5-16,26,32H,4,17H2,1-3H3InChIKey
BGYHKUUXKPDKKZ-UHFFFAOYSA-NSynonyms
5benzyl4(3ethoxy4hydroxyphenyl)1methyl3(4methylphenyl)45dihydropyrrolo(34c)pyrazol6(1H)one
5benzyl4(3ethoxy4hydroxyphenyl)1methyl3(4methylphenyl)4Hpyrrolo(34c)pyrazol6one
CCOC1=C(C=CC(=C1)C2C3=C(C(=O)N2CC4=CC=CC=C4)N(N=C3C5=CC=C(C=C5)C)C)O
InChI=1SC28H27N3O3c1434231621(141522(23)32)262425(20121018(2)111320)2930(3)27(24)28(33)31(26)17198657919h5162632H417H213H3
MFCD18078396
ZINC000032593844
ZINC000032593845
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