Vitas-M small molecule compound
butyl 2-chloro-5-{5-[(E)-2-cyano-2-(5-methyl-1H-benzimidazol-2-yl)ethenyl]furan-2-yl}benzoate
Catalog ID
STL507377
SMILES CCCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C(/c1nc2c([nH]1)ccc(c2)C)\C#N
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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 C26H22ClN3O3 MW 459.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O3/c1-3-4-11-32-26(31)20-14-17(6-8-21(20)27)24-10-7-19(33-24)13-18(15-28)25-29-22-9-5-16(2)12-23(22)30-25/h5-10,12-14H,3-4,11H2,1-2H3,(H,29,30)/b18-13+InChIKey
WABVJJNPAMCMHV-QGOAFFKASA-NSynonyms
5759798
butyl2chloro5(5((~(E))2cyano2(6methyl1~(H)benzimidazol2yl)ethenyl)furan2yl)benzoate
butyl2chloro5(5((E)2cyano2(5methyl1Hbenzimidazol2yl)ethenyl)furan2yl)benzoate
BUTYL2CHLORO5(5((E)2CYANO2(6METHYL1HBENZIMIDAZOL2YL)ETHENYL)FURAN2YL)BENZOATE
BUTYL2CHLORO5(5(2CYANO2(6METHYL1HBENZIMIDAZOL2YL)VINYL)2FURYL)BENZOATE
InChI=1SC26H22ClN3O3c134113226(31)201417(6821(20)27)2410719(3324)1318(1528)2529229516(2)1223(22)3025h5101214H3411H212H3(H2930)b1813+
MFCD31615092
ZINC000013602625
ZINC13602625
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