Vitas-M small molecule compound
(2Z)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-1-benzofuran-3(2H)-one
Catalog ID
STL034989
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3CN1CCN(CC1)C)O)cn2CC
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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 C26H29N3O4 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4/c1-4-29-15-17(20-14-18(32-3)5-7-22(20)29)13-24-25(31)19-6-8-23(30)21(26(19)33-24)16-28-11-9-27(2)10-12-28/h5-8,13-15,30H,4,9-12,16H2,1-3H3/b24-13-InChIKey
XIVHYGMAEFNNNU-CFRMEGHHSA-NSynonyms
(2Z)2((1ethyl5methoxy1Hindol3yl)methylidene)6hydroxy7((4methylpiperazin1yl)methyl)1benzofuran3(2H)one
(2Z)2((1ethyl5methoxyindol3yl)methylidene)7((4methylpiperazin1ium1yl)methyl)3oxo1benzofuran6olate
(E)2((1ethyl5methoxy1Hindol3yl)methylene)6hydroxy7((4methylpiperazin1yl)methyl)benzofuran3(2H)one
2((1ETHYL5METHOXYINDOL3YL)METHYLENE)6HYDROXY7((4METHYLPIPERAZINYL)METHYL)BENZO(B)FURAN3ONE
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)(O))C(NH+)5CCN(CC5)C
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3CN1CCN(CC1)C)O)cn2CC
InChI=1SC26H29N3O4c14291517(201418(323)5722(20)29)132425(31)196823(30)21(26(19)3324)162811927(2)101228h58131530H491216H213H3b2413
MFCD18191946
ZINC000028182788
ZINC28182788
Check stock
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