Vitas-M small molecule compound
(2Z)-7-[(dibutylamino)methyl]-6-hydroxy-2-[(1-methyl-1H-indol-3-yl)methylidene]-1-benzofuran-3(2H)-one
Catalog ID
STK992765
SMILES CCCCN(Cc1c(O)ccc2c1O/C(=C\c1cn(c3c1cccc3)C)/C2=O)CCCC
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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 C27H32N2O3 MW 432.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O3/c1-4-6-14-29(15-7-5-2)18-22-24(30)13-12-21-26(31)25(32-27(21)22)16-19-17-28(3)23-11-9-8-10-20(19)23/h8-13,16-17,30H,4-7,14-15,18H2,1-3H3/b25-16-InChIKey
DBGDDNVVIJTJOT-XYGWBWBKSA-NSynonyms
(2Z)7((dibutylamino)methyl)6hydroxy2((1methyl1Hindol3yl)methylidene)1benzofuran3(2H)one
(2Z)7((dibutylazaniumyl)methyl)2((1methylindol3yl)methylidene)3oxo1benzofuran6olate
(E)7((dibutylamino)methyl)6hydroxy2((1methyl1Hindol3yl)methylene)benzofuran3(2H)one
7((DIBUTYLAMINO)METHYL)6HYDROXY2((1METHYLINDOL3YL)METHYLENE)BENZO(B)FURAN3ONE
CCCC(NH+)(CCCC)CC1=C(C=CC2=C1OC(=CC3=CN(C4=CC=CC=C43)C)C2=O)(O)
CCCCN(Cc1c(O)ccc2c1OC(=Cc1cn(c3c1cccc3)C)C2=O)CCCC
InChI=1SC27H32N2O3c1461429(15752)182224(30)13122126(31)25(3227(21)22)16191728(3)2311981020(19)23h813161730H47141518H213H3b2516
MFCD18184624
ZINC000028182448
ZINC28182448
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