Vitas-M small molecule compound

5-ethyl-N-[(2S)-1-[(2-hydroxyethyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide

Catalog ID
STK607855
SMILES CSCC[C@@H](C(=O)NCCO)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 C20H25N3O6S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O6S/c1-3-23-10-13(18(25)12-8-16-17(9-15(12)23)29-11-28-16)19(26)22-14(4-7-30-2)20(27)21-5-6-24/h8-10,14,24H,3-7,11H2,1-2H3,(H,21,27)(H,22,26)/t14-/m0/s1
InChIKey
UUNLFYKGFLUXDV-AWEZNQCLSA-N
Synonyms
1014045-25-0
(S)5ethylN(1((2hydroxyethyl)amino)4(methylthio)1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
1014045250
5ethylN((2S)1((2hydroxyethyl)amino)4(methylsulfanyl)1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1(2hydroxyethylamino)4methylsulfanyl1oxobutan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CCSC)C(=O)NCCO
CSCC(C@@H)(C(=O)NCCO)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
InChI=1SC20H25N3O6Sc13231013(18(25)1281617(915(12)23)29112816)19(26)2214(47302)20(27)215624h8101424H3711H212H3(H2127)(H2226)t14m0s1
MFCD08291811
ZINC000009435616
ZINC09435616
ZINC9435616

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Available files

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