Vitas-M small molecule compound
5-ethyl-N-{(2S)-4-(methylsulfanyl)-1-oxo-1-[(tetrahydrofuran-2-ylmethyl)amino]butan-2-yl}-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Catalog ID
STK610235
SMILES CSCC[C@@H](C(=O)NCC1CCCO1)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 C23H29N3O6S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O6S/c1-3-26-12-16(21(27)15-9-19-20(10-18(15)26)32-13-31-19)22(28)25-17(6-8-33-2)23(29)24-11-14-5-4-7-30-14/h9-10,12,14,17H,3-8,11,13H2,1-2H3,(H,24,29)(H,25,28)/t14?,17-/m0/s1InChIKey
CVVIWPGONAJRLJ-JRZJBTRGSA-NSynonyms
956926-94-65ethylN((2S)4(methylsulfanyl)1oxo1((tetrahydrofuran2ylmethyl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)4(methylthio)1oxo1(((tetrahydrofuran2yl)methyl)amino)butan2yl)8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
5ethylN((2S)4methylsulfanyl1oxo1(oxolan2ylmethylamino)butan2yl)8oxo(13)dioxolo(45g)quinoline7carboxamide
956926946
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC(CCSC)C(=O)NCC4CCCO4
InChI=1SC23H29N3O6Sc13261216(21(27)1591920(1018(15)26)32133119)22(28)2517(68332)23(29)2411145473014h910121417H381113H212H3(H2429)(H2528)t14?17m0s1
MFCD10488487
ZINC000009410767
ZINC000013608530
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