Vitas-M small molecule compound
(2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-4'-{[2-methyl-2-(morpholin-4-yl)propyl]amino}-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Catalog ID
STL549701
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=CC1=O)NCC(N1CCOCC1)(C)C)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 C24H31ClN2O6 MW 478.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31ClN2O6/c1-14-10-15(26-13-23(2,3)27-6-8-32-9-7-27)11-18(28)24(14)22(29)19-16(30-4)12-17(31-5)20(25)21(19)33-24/h11-12,14,26H,6-10,13H2,1-5H3/t14-,24+/m1/s1InChIKey
HLTPJZYIJUMLAE-SHACYNPGSA-NSynonyms
(1S6R)7chloro46dimethoxy6methyl4((2methyl2morpholinopropyl)amino)3Hspiro(benzofuran21cyclohex(3)ene)23dione
(2~(S)5~(R))7chloro46dimethoxy5methyl3((2methyl2morpholin4ylpropyl)amino)spiro(1benzofuran26cyclohex2ene)13dione
(2S6R)7chloro46dimethoxy6methyl4((2methyl2(morpholin4yl)propyl)amino)2H3Hspiro(1benzofuran21cyclohex(3)ene)23dione
127253671
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC(=CC1=O)NCC(N1CCOCC1)(C)C)Cl
InChI=1SC24H31ClN2O6c1141015(261323(23)2768329727)1118(28)24(14)22(29)1916(304)1217(315)20(25)21(19)3324h11121426H61013H215H3t1424+m1s1
ZINC000604403992
ZINC604403992
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