Vitas-M small molecule compound
7-{2-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-2-oxoethoxy}-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one
Catalog ID
STL471725
SMILES O=C(N1CCN(CC1)C1CCS(=O)(=O)C1)COc1cc(O)c2c(c1)OC(CC2=O)(C)C
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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 C21H28N2O7S MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O7S/c1-21(2)11-17(25)20-16(24)9-15(10-18(20)30-21)29-12-19(26)23-6-4-22(5-7-23)14-3-8-31(27,28)13-14/h9-10,14,24H,3-8,11-13H2,1-2H3InChIKey
AZHXYFLWXFJXEO-UHFFFAOYSA-NSynonyms
1374509-90-61374509906
7(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethoxy)5hydroxy22dimethyl23dihydro4Hchromen4one
7(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethoxy)5hydroxy22dimethylchroman4one
7(2(4(11dioxothiolan3yl)piperazin1yl)2oxoethoxy)5hydroxy22dimethyl3Hchromen4one
CC1(CC(=O)C2=C(C=C(C=C2O1)OCC(=O)N3CCN(CC3)C4CCS(=O)(=O)C4)O)C
InChI=1SC21H28N2O7Sc121(2)1117(25)2016(24)915(1018(20)3021)291219(26)236422(5723)143831(2728)1314h9101424H381113H212H3
MFCD27962224
ZINC000072325208
ZINC000072325211
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