Vitas-M small molecule compound
(2S,6'R)-7-chloro-4'-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)amino]-4,6-dimethoxy-6'-methyl-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Catalog ID
STL551326
SMILES COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=CC1=O)Nc1ccc2c(c1)n(C)c(=O)n2C)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 C25H24ClN3O6 MW 497.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O6/c1-12-8-14(27-13-6-7-15-16(9-13)29(3)24(32)28(15)2)10-19(30)25(12)23(31)20-17(33-4)11-18(34-5)21(26)22(20)35-25/h6-7,9-12,27H,8H2,1-5H3/t12-,25+/m1/s1InChIKey
BIENJRZDAFTOBA-YDBLSZJJSA-NSynonyms
(1S6R)7chloro4((13dimethyl2oxo23dihydro1Hbenzo(d)imidazol5yl)amino)46dimethoxy6methyl3Hspiro(benzofuran21cyclohex(3)ene)23dione
(2~(S)5~(R))7chloro3((13dimethyl2oxobenzimidazol5yl)amino)46dimethoxy5methylspiro(1benzofuran26cyclohex2ene)13dione
(2S6R)7chloro4((13dimethyl2oxo23dihydro1Hbenzimidazol5yl)amino)46dimethoxy6methyl2H3Hspiro(1benzofuran21cyclohex(3)ene)23dione
125429514
COc1cc(OC)c(c2c1C(=O)(C@)1(O2)(C@H)(C)CC(=CC1=O)Nc1ccc2c(c1)n(C)c(=O)n2C)Cl
InChI=1SC25H24ClN3O6c112814(2713671516(913)29(3)24(32)28(15)2)1019(30)25(12)23(31)2017(334)1118(345)21(26)22(20)3525h6791227H8H215H3t1225+m1s1
ZINC000524730901
ZINC524730901
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