Vitas-M small molecule compound

5-ethyl-N-{(2S)-3-methyl-1-oxo-1-[(pyridin-3-ylmethyl)amino]butan-2-yl}-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide

Catalog ID
STK615420
SMILES CCn1cc(C(=O)N[C@H](C(=O)NCc2cccnc2)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 C24H26N4O5 MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O5/c1-4-28-12-17(22(29)16-8-19-20(9-18(16)28)33-13-32-19)23(30)27-21(14(2)3)24(31)26-11-15-6-5-7-25-10-15/h5-10,12,14,21H,4,11,13H2,1-3H3,(H,26,31)(H,27,30)/t21-/m0/s1
InChIKey
USDKJROVPDIRRJ-NRFANRHFSA-N
Synonyms
956617-21-3
(S)5ethylN(3methyl1oxo1((pyridin3ylmethyl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)3methyl1oxo1((pyridin3ylmethyl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)3methyl1oxo1(pyridin3ylmethylamino)butan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
956617213
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(C(C)C)C(=O)NCC4=CN=CC=C4
CCn1cc(C(=O)N(C@H)(C(=O)NCc2cccnc2)C(C)C)c(=O)c2c1cc1OCOc1c2
InChI=1SC24H26N4O5c14281217(22(29)1681920(918(16)28)33133219)23(30)2721(14(2)3)24(31)261115657251015h510121421H41113H213H3(H2631)(H2730)t21m0s1
MFCD08743805
ZINC000009060754
ZINC09060754
ZINC9060754

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.