Vitas-M small molecule compound
5-ethyl-N-[(2S)-1-{[(1-ethylpyrrolidin-2-yl)methyl]amino}-3-methyl-1-oxobutan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Catalog ID
STL535127
SMILES CCN1CCCC1CNC(=O)[C@H](C(C)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
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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 C25H34N4O5 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N4O5/c1-5-28-9-7-8-16(28)12-26-25(32)22(15(3)4)27-24(31)18-13-29(6-2)19-11-21-20(33-14-34-21)10-17(19)23(18)30/h10-11,13,15-16,22H,5-9,12,14H2,1-4H3,(H,26,32)(H,27,31)/t16?,22-/m0/s1InChIKey
BOWHEKQBQVVVER-XLDIYJRPSA-NSynonyms
956952-04-816407762
5ethyl~(N)((2~(S))1((1ethylpyrrolidin2yl)methylamino)3methyl1oxobutan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1(((1ethylpyrrolidin2yl)methyl)amino)3methyl1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
956952048
CCN1CCCC1CNC(=O)(C@H)(C(C)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
InChI=1SC25H34N4O5c152897816(28)122625(32)22(15(3)4)2724(31)181329(62)19112120(33143421)1017(19)23(18)30h101113151622H591214H214H3(H2632)(H2731)t16?22m0s1
ZINC000012891773
ZINC000012891783
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