Vitas-M small molecule compound
(2Z)-7-[(4-ethylpiperazin-1-ium-1-yl)methyl]-2-(1H-indol-3-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK857126
SMILES CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1c[nH]c3c1cccc3)/C2=O
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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 C24H25N3O3 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3/c1-2-26-9-11-27(12-10-26)15-19-21(28)8-7-18-23(29)22(30-24(18)19)13-16-14-25-20-6-4-3-5-17(16)20/h3-8,13-14,25,28H,2,9-12,15H2,1H3/b22-13-InChIKey
UASXPDPJFZVXLJ-XKZIYDEJSA-NSynonyms
896838-55-4(2Z)7((4ethylpiperazin1ium1yl)methyl)2(1Hindol3ylmethylidene)3oxo1benzofuran6olate
(2Z)7((4ethylpiperazin1ium1yl)methyl)2(1Hindol3ylmethylidene)3oxo23dihydro1benzofuran6olate
(2Z)7((4ETHYLPIPERAZIN1YL)METHYL)6HYDROXY2(1HINDOL3YLMETHYLIDENE)1BENZOFURAN3ONE
7((4ETHYLPIPERAZINYL)METHYL)6HYDROXY2(INDOL3YLMETHYLENE)BENZO(B)FURAN3ONE
896838554
CCN1CC(NH+)(CC1)Cc1c((O))ccc2c1OC(=Cc1c(nH)c3c1cccc3)C2=O
CCN1CC(NH+)(CC1)CC2=C(C=CC3=C2OC(=CC4=CNC5=CC=CC=C54)C3=O)(O)
InChI=1SC24H25N3O3c122691127(121026)151921(28)871823(29)22(3024(18)19)1316142520643517(16)20h3813142528H291215H21H3b2213
MFCD06601116
ZINC000019369654
ZINC19369654
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