Vitas-M small molecule compound
methyl 3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-3-[(2Z)-6-hydroxy-2-(morpholin-4-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-7-yl]propanoate
Catalog ID
STL549531
SMILES COC(=O)CC(c1c(O)ccc2c1O/C(=C\N1CCOCC1)/C2=O)c1ccc2c(c1)n(C)c(=O)n2C
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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 C26H27N3O7 MW 493.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O7/c1-27-18-6-4-15(12-19(18)28(2)26(27)33)17(13-22(31)34-3)23-20(30)7-5-16-24(32)21(36-25(16)23)14-29-8-10-35-11-9-29/h4-7,12,14,17,30H,8-11,13H2,1-3H3/b21-14-InChIKey
ZWBTVBYYHPQPEZ-STZFKDTASA-NSynonyms
(Z)methyl3(13dimethyl2oxo23dihydro1Hbenzo(d)imidazol5yl)3(6hydroxy2(morpholinomethylene)3oxo23dihydrobenzofuran7yl)propanoate
127252665
COC(=O)CC(c1c(O)ccc2c1OC(=CN1CCOCC1)C2=O)c1ccc2c(c1)n(C)c(=O)n2C
InChI=1SC26H27N3O7c127186415(1219(18)28(2)26(27)33)17(1322(31)343)2320(30)751624(32)21(3625(16)23)14298103511929h4712141730H81113H213H3b2114
methyl3(13dimethyl2oxo23dihydro1Hbenzimidazol5yl)3((2Z)6hydroxy2(morpholin4ylmethylidene)3oxo23dihydro1benzofuran7yl)propanoate
methyl3(13dimethyl2oxobenzimidazol5yl)3((2~(Z))6hydroxy2(morpholin4ylmethylidene)3oxo1benzofuran7yl)propanoate
MFCD31757035
ZINC000604406068
ZINC001081803980
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