Vitas-M small molecule compound
(2Z)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-6-hydroxy-7-[(4-methylpiperidin-1-yl)methyl]-1-benzofuran-3(2H)-one
Catalog ID
STL034997
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3CN1CCC(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 C27H30N2O4 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O4/c1-4-29-15-18(21-14-19(32-3)5-7-23(21)29)13-25-26(31)20-6-8-24(30)22(27(20)33-25)16-28-11-9-17(2)10-12-28/h5-8,13-15,17,30H,4,9-12,16H2,1-3H3/b25-13-InChIKey
CMBHOEYVCJCPAT-MXAYSNPKSA-NSynonyms
(2Z)2((1ethyl5methoxy1Hindol3yl)methylidene)6hydroxy7((4methylpiperidin1yl)methyl)1benzofuran3(2H)one
(2Z)2((1ethyl5methoxyindol3yl)methylidene)6hydroxy7((4methylpiperidin1yl)methyl)1benzofuran3one
(E)2((1ethyl5methoxy1Hindol3yl)methylene)6hydroxy7((4methylpiperidin1yl)methyl)benzofuran3(2H)one
2((1ETHYL5METHOXYINDOL3YL)METHYLENE)6HYDROXY7((4METHYLPIPERIDYL)METHYL)BENZO(B)FURAN3ONE
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)O)CN5CCC(CC5)C
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3CN1CCC(CC1)C)O)cn2CC
InChI=1SC27H30N2O4c14291518(211419(323)5723(21)29)132526(31)206824(30)22(27(20)3325)162811917(2)101228h5813151730H491216H213H3b2513
MFCD18191954
ZINC000028182808
ZINC28182808
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