Vitas-M small molecule compound
7-chloro-4,6-dimethoxy-4'-({3-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]phenyl}amino)-6'-methyl-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Catalog ID
STL551056
SMILES COCc1[nH]nc(n1)c1cccc(c1)NC1=CC(=O)C2(C(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 C26H25ClN4O6 MW 524.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O6/c1-13-8-16(28-15-7-5-6-14(9-15)25-29-20(12-34-2)30-31-25)10-19(32)26(13)24(33)21-17(35-3)11-18(36-4)22(27)23(21)37-26/h5-7,9-11,13,28H,8,12H2,1-4H3,(H,29,30,31)InChIKey
MEVAVSNJWPOGJT-UHFFFAOYSA-NSynonyms
(1S6R)7chloro46dimethoxy4((3(3(methoxymethyl)1H124triazol5yl)phenyl)amino)6methyl3Hspiro(benzofuran21cyclohex(3)ene)23dione
132285895
7chloro46dimethoxy3(3(5(methoxymethyl)1~(H)124triazol3yl)anilino)5methylspiro(1benzofuran26cyclohex2ene)13dione
7chloro46dimethoxy4((3(5(methoxymethyl)1H124triazol3yl)phenyl)amino)6methyl2H3Hspiro(1benzofuran21cyclohex(3)ene)23dione
COCc1n(nH)c(n1)c1cccc(c1)NC1=CC(=O)(C@)2((C@@H)(C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC
InChI=1SC26H25ClN4O6c113816(281575614(915)252920(12342)303125)1019(32)26(13)24(33)2117(353)1118(364)22(27)23(21)3726h579111328H812H214H3(H293031)
MFCD31757923
ZINC000524729277
ZINC000888089162
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