Vitas-M small molecule compound
5-ethyl-N-[(2S)-4-(methylsulfanyl)-1-{[3-(morpholin-4-yl)propyl]amino}-1-oxobutan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Catalog ID
STK611087
SMILES CSCC[C@@H](C(=O)NCCCN1CCOCC1)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 C25H34N4O6S MW 518.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N4O6S/c1-3-29-15-18(23(30)17-13-21-22(14-20(17)29)35-16-34-21)24(31)27-19(5-12-36-2)25(32)26-6-4-7-28-8-10-33-11-9-28/h13-15,19H,3-12,16H2,1-2H3,(H,26,32)(H,27,31)/t19-/m0/s1InChIKey
SJNXVEKLJCEOEK-IBGZPJMESA-NSynonyms
957024-69-0(S)5ethylN(4(methylthio)1((3morpholinopropyl)amino)1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)4(methylsulfanyl)1((3(morpholin4yl)propyl)amino)1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)4methylsulfanyl1(3morpholin4ylpropylamino)1oxobutan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
957024690
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CCSC)C(=O)NCCCN4CCOCC4
CSCC(C@@H)(C(=O)NCCCN1CCOCC1)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
InChI=1SC25H34N4O6Sc13291518(23(30)17132122(1420(17)29)35163421)24(31)2719(512362)25(32)26647288103311928h131519H31216H212H3(H2632)(H2731)t19m0s1
MFCD08290518
ZINC000020589840
ZINC20589840
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.