Vitas-M small molecule compound
ethyl 4-[(4Z)-4-({5-[1,3-dioxo-2-(propan-2-yl)-2,3-dihydro-1H-isoindol-5-yl]furan-2-yl}methylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Catalog ID
STL432556
SMILES CCOC(=O)c1ccc(cc1)N1N=C(/C(=C/c2ccc(o2)c2ccc3c(c2)C(=O)N(C3=O)C(C)C)/C1=O)C
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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 C29H25N3O6 MW 511.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O6/c1-5-37-29(36)18-6-9-20(10-7-18)32-28(35)23(17(4)30-32)15-21-11-13-25(38-21)19-8-12-22-24(14-19)27(34)31(16(2)3)26(22)33/h6-16H,5H2,1-4H3/b23-15-InChIKey
QFZPCMOMHQWSSS-HAHDFKILSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC5=C(C=C4)C(=O)N(C5=O)C(C)C)C(=N2)C
CCOC(=O)c1ccc(cc1)N1N=C(C(=Cc2ccc(o2)c2ccc3c(c2)C(=O)N(C3=O)C(C)C)C1=O)C
ethyl4((4Z)4((5(13dioxo2(propan2yl)23dihydro1Hisoindol5yl)furan2yl)methylidene)3methyl5oxo45dihydro1Hpyrazol1yl)benzoate
ETHYL4((4Z)4((5(13DIOXO2PROPAN2YLISOINDOL5YL)FURAN2YL)METHYLIDENE)3METHYL5OXOPYRAZOL1YL)BENZOATE
ETHYL4(4((5(2ISOPROPYL13DIOXO23DIHYDRO1HISOINDOL5YL)2FURYL)METHYLENE)3METHYL5OXO45DIHYDRO1HPYRAZOL1YL)BENZOATE
InChI=1SC29H25N3O6c153729(36)186920(10718)3228(35)23(17(4)3032)1521111325(3821)198122224(1419)27(34)31(16(2)3)26(22)33h616H5H214H3b2315
MFCD03216718
ZINC000008497054
ZINC08497054
ZINC8497054
Check stock
See real-time availability and sample size for STL432556 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.