Vitas-M small molecule compound
5-ethyl-N-{(2S)-3-methyl-1-oxo-1-[(2-oxo-2H-chromen-6-yl)amino]butan-2-yl}-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Catalog ID
STK604234
SMILES CCn1cc(C(=O)N[C@H](C(=O)Nc2ccc3c(c2)ccc(=O)o3)C(C)C)c(=O)c2c1cc1OCOc1c2
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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 C27H25N3O7 MW 503.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O7/c1-4-30-12-18(25(32)17-10-21-22(11-19(17)30)36-13-35-21)26(33)29-24(14(2)3)27(34)28-16-6-7-20-15(9-16)5-8-23(31)37-20/h5-12,14,24H,4,13H2,1-3H3,(H,28,34)(H,29,33)/t24-/m0/s1InChIKey
RQJBADBYKQRULL-DEOSSOPVSA-NSynonyms
957001-93-3(S)5ethylN(3methyl1oxo1((2oxo2Hchromen6yl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)3methyl1oxo1((2oxo2Hchromen6yl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)3methyl1oxo1((2oxochromen6yl)amino)butan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
957001933
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(C(C)C)C(=O)NC4=CC5=C(C=C4)OC(=O)C=C5
CCn1cc(C(=O)N(C@H)(C(=O)Nc2ccc3c(c2)ccc(=O)o3)C(C)C)c(=O)c2c1cc1OCOc1c2
InChI=1SC27H25N3O7c14301218(25(32)17102122(1119(17)30)36133521)26(33)2924(14(2)3)27(34)2816672015(916)5823(31)3720h5121424H413H213H3(H2834)(H2933)t24m0s1
MFCD08745564
ZINC000009184171
ZINC09184171
ZINC9184171
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.