Vitas-M small molecule compound
5-ethyl-N-{(2S)-4-(methylsulfanyl)-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
STK606124
SMILES CSCC[C@@H](C(=O)NCc1cccnc1)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 C24H26N4O5S MW 482.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O5S/c1-3-28-13-17(22(29)16-9-20-21(10-19(16)28)33-14-32-20)23(30)27-18(6-8-34-2)24(31)26-12-15-5-4-7-25-11-15/h4-5,7,9-11,13,18H,3,6,8,12,14H2,1-2H3,(H,26,31)(H,27,30)/t18-/m0/s1InChIKey
WZFWTCWJCNYLKC-SFHVURJKSA-NSynonyms
1013754-91-0(S)5ethylN(4(methylthio)1oxo1((pyridin3ylmethyl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
1013754910
5ethylN((2S)4(methylsulfanyl)1oxo1((pyridin3ylmethyl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)4methylsulfanyl1oxo1(pyridin3ylmethylamino)butan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CCSC)C(=O)NCC4=CN=CC=C4
CSCC(C@@H)(C(=O)NCc1cccnc1)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
InChI=1SC24H26N4O5Sc13281317(22(29)1692021(1019(16)28)33143220)23(30)2718(68342)24(31)261215547251115h4579111318H3681214H212H3(H2631)(H2730)t18m0s1
MFCD08292901
ZINC000009411167
ZINC09411167
ZINC9411167
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.