Vitas-M small molecule compound
5-ethyl-N-[(2S)-4-(methylsulfanyl)-1-oxo-1-{[3-(2-oxopyrrolidin-1-yl)propyl]amino}butan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Catalog ID
STK606496
SMILES CSCC[C@@H](C(=O)NCCCN1CCCC1=O)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 C25H32N4O6S MW 516.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O6S/c1-3-28-14-17(23(31)16-12-20-21(13-19(16)28)35-15-34-20)24(32)27-18(7-11-36-2)25(33)26-8-5-10-29-9-4-6-22(29)30/h12-14,18H,3-11,15H2,1-2H3,(H,26,33)(H,27,32)/t18-/m0/s1InChIKey
SOEMTNJSLQIVMZ-SFHVURJKSA-NSynonyms
1014063-65-0(S)5ethylN(4(methylthio)1oxo1((3(2oxopyrrolidin1yl)propyl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
1014063650
5ethylN((2S)4(methylsulfanyl)1oxo1((3(2oxopyrrolidin1yl)propyl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)4methylsulfanyl1oxo1(3(2oxopyrrolidin1yl)propylamino)butan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CCSC)C(=O)NCCCN4CCCC4=O
CSCC(C@@H)(C(=O)NCCCN1CCCC1=O)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
InChI=1SC25H32N4O6Sc13281417(23(31)16122021(1319(16)28)35153420)24(32)2718(711362)25(33)2685102994622(29)30h121418H31115H212H3(H2633)(H2732)t18m0s1
MFCD08743592
ZINC000009134439
ZINC09134439
ZINC9134439
Check stock
See real-time availability and sample size for STK606496 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.