Vitas-M small molecule compound
(2S,6'R)-7-chloro-4,6-dimethoxy-4'-({2-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]ethyl}amino)-6'-methyl-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Catalog ID
STL550503
SMILES COCCc1noc(n1)CCNC1=CC(=O)[C@]2([C@@H](C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC
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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 C23H26ClN3O7 MW 491.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26ClN3O7/c1-12-9-13(25-7-5-18-26-17(27-34-18)6-8-30-2)10-16(28)23(12)22(29)19-14(31-3)11-15(32-4)20(24)21(19)33-23/h10-12,25H,5-9H2,1-4H3/t12-,23+/m1/s1InChIKey
MBOSLZFQJROICP-SPSFWMDKSA-NSynonyms
(1S6R)7chloro46dimethoxy4((2(3(2methoxyethyl)124oxadiazol5yl)ethyl)amino)6methyl3Hspiro(benzofuran21cyclohex(3)ene)23dione
(2~(S)5~(R))7chloro46dimethoxy3(2(3(2methoxyethyl)124oxadiazol5yl)ethylamino)5methylspiro(1benzofuran26cyclohex2ene)13dione
(2S6R)7chloro46dimethoxy4((2(3(2methoxyethyl)124oxadiazol5yl)ethyl)amino)6methyl2H3Hspiro(1benzofuran21cyclohex(3)ene)23dione
127253925
COCCc1noc(n1)CCNC1=CC(=O)(C@)2((C@@H)(C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC
InChI=1SC23H26ClN3O7c112913(2575182617(273418)68302)1016(28)23(12)22(29)1914(313)1115(324)20(24)21(19)3323h101225H59H214H3t1223+m1s1
ZINC000604404234
ZINC604404234
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