Vitas-M small molecule compound
7-chloro-4,6-dimethoxy-6'-methyl-4'-{[2-(phenylsulfonyl)ethyl]amino}-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Catalog ID
STL549949
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC(=CC1=O)NCCS(=O)(=O)c1ccccc1)Cl
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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 C24H24ClNO7S MW 505.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClNO7S/c1-14-11-15(26-9-10-34(29,30)16-7-5-4-6-8-16)12-19(27)24(14)23(28)20-17(31-2)13-18(32-3)21(25)22(20)33-24/h4-8,12-14,26H,9-11H2,1-3H3InChIKey
MJJLPNRSLCDZDL-UHFFFAOYSA-NSynonyms
(1S6R)7chloro46dimethoxy6methyl4((2(phenylsulfonyl)ethyl)amino)3Hspiro(benzofuran21cyclohex(3)ene)23dione
132286286
3(2(benzenesulfonyl)ethylamino)7chloro46dimethoxy5methylspiro(1benzofuran26cyclohex2ene)13dione
7chloro46dimethoxy6methyl4((2(phenylsulfonyl)ethyl)amino)2H3Hspiro(1benzofuran21cyclohex(3)ene)23dione
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC(=CC1=O)NCCS(=O)(=O)c1ccccc1)Cl
InChI=1SC24H24ClNO7Sc1141115(2691034(2930)167546816)1219(27)24(14)23(28)2017(312)1318(323)21(25)22(20)3324h48121426H911H213H3
MFCD31757307
ZINC000604405185
ZINC000888089875
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