Vitas-M small molecule compound
5-ethyl-N-[(2S)-1-[(2-hydroxyethyl)(methyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Catalog ID
STK628811
SMILES CSCC[C@@H](C(=O)N(CCO)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 C21H27N3O6S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O6S/c1-4-24-11-14(19(26)13-9-17-18(10-16(13)24)30-12-29-17)20(27)22-15(5-8-31-3)21(28)23(2)6-7-25/h9-11,15,25H,4-8,12H2,1-3H3,(H,22,27)/t15-/m0/s1InChIKey
HYEZHXYDYJQCJH-HNNXBMFYSA-NSynonyms
956503-71-2(S)5ethylN(1((2hydroxyethyl)(methyl)amino)4(methylthio)1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1((2hydroxyethyl)(methyl)amino)4(methylsulfanyl)1oxobutan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)1(2hydroxyethyl(methyl)amino)4methylsulfanyl1oxobutan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
956503712
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CCSC)C(=O)N(C)CCO
CSCC(C@@H)(C(=O)N(CCO)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1
InChI=1SC21H27N3O6Sc14241114(19(26)1391718(1016(13)24)30122917)20(27)2215(58313)21(28)23(2)6725h9111525H4812H213H3(H2227)t15m0s1
MFCD08749851
ZINC000009418705
ZINC09418705
ZINC9418705
Check stock
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Check stock on Vitas-MAvailable files
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