Vitas-M small molecule compound
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-2-[(5-hydroxy-2,2-dimethyl-4-oxo-3,4-dihydro-2H-chromen-7-yl)oxy]acetamide
Catalog ID
STL544030
SMILES CC(C[C@@H](c1nc2c([nH]1)cccc2)NC(=O)COc1cc(O)c2c(c1)OC(CC2=O)(C)C)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 C25H29N3O5 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O5/c1-14(2)9-18(24-27-16-7-5-6-8-17(16)28-24)26-22(31)13-32-15-10-19(29)23-20(30)12-25(3,4)33-21(23)11-15/h5-8,10-11,14,18,29H,9,12-13H2,1-4H3,(H,26,31)(H,27,28)/t18-/m0/s1InChIKey
GWUSIXANMIBWOR-SFHVURJKSA-NSynonyms
(S)N(1(1Hbenzo(d)imidazol2yl)3methylbutyl)2((5hydroxy22dimethyl4oxochroman7yl)oxy)acetamide
~(N)((1~(S))1(1~(H)benzimidazol2yl)3methylbutyl)2((5hydroxy22dimethyl4oxo3~(H)chromen7yl)oxy)acetamide
91637657
CC(C(C@@H)(c1nc2c((nH)1)cccc2)NC(=O)COc1cc(O)c2c(c1)OC(CC2=O)(C)C)C
InChI=1SC25H29N3O5c114(2)918(242716756817(16)2824)2622(31)1332151019(29)2320(30)1225(34)3321(23)1115h581011141829H91213H214H3(H2631)(H2728)t18m0s1
N((1S)1(1Hbenzimidazol2yl)3methylbutyl)2((5hydroxy22dimethyl4oxo34dihydro2Hchromen7yl)oxy)acetamide
ZINC000217781291
ZINC217781291
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