Vitas-M small molecule compound
7-chloro-4,6-dimethoxy-6'-methyl-4'-{[2-(2H-tetrazol-5-yl)phenyl]amino}-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Catalog ID
STL550595
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC(=CC1=O)Nc1ccccc1c1n[nH]nn1)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 C23H20ClN5O5 MW 481.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN5O5/c1-11-8-12(25-14-7-5-4-6-13(14)22-26-28-29-27-22)9-17(30)23(11)21(31)18-15(32-2)10-16(33-3)19(24)20(18)34-23/h4-7,9-11,25H,8H2,1-3H3,(H,26,27,28,29)InChIKey
PWFLALVIKWXRTL-UHFFFAOYSA-NSynonyms
(1S6R)4((2(1Htetrazol5yl)phenyl)amino)7chloro46dimethoxy6methyl3Hspiro(benzofuran21cyclohex(3)ene)23dione
132286190
7chloro46dimethoxy5methyl3(2(2~(H)tetrazol5yl)anilino)spiro(1benzofuran26cyclohex2ene)13dione
7chloro46dimethoxy6methyl4((2(2Htetrazol5yl)phenyl)amino)2H3Hspiro(1benzofuran21cyclohex(3)ene)23dione
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC(=CC1=O)Nc1ccccc1c1nnn(nH)1)Cl
InChI=1SC23H20ClN5O5c111812(2514754613(14)222628292722)917(30)23(11)21(31)1815(322)1016(333)19(24)20(18)3423h4791125H8H213H3(H26272829)
MFCD31757668
ZINC000604404647
ZINC000888089925
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