Vitas-M small molecule compound
2-(4-chlorophenyl)-2-oxoethyl (2E)-3-(1,3-benzodioxol-5-yl)-2-({[4-(2-methylpropoxy)phenyl]carbonyl}amino)prop-2-enoate
Catalog ID
STK524624
SMILES CC(COc1ccc(cc1)C(=O)N/C(=C/c1ccc2c(c1)OCO2)/C(=O)OCC(=O)c1ccc(cc1)Cl)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 C29H26ClNO7 MW 535.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClNO7/c1-18(2)15-35-23-10-6-21(7-11-23)28(33)31-24(13-19-3-12-26-27(14-19)38-17-37-26)29(34)36-16-25(32)20-4-8-22(30)9-5-20/h3-14,18H,15-17H2,1-2H3,(H,31,33)/b24-13+InChIKey
WSCMXXRSOVZNET-ZMOGYAJESA-NSynonyms
370071-45-7(2(4CHLOROPHENYL)2OXOETHYL)(E)3(13BENZODIOXOL5YL)2((4(2METHYLPROPOXY)BENZOYL)AMINO)PROP2ENOATE
(E)2(4chlorophenyl)2oxoethyl3(benzo(d)(13)dioxol5yl)2(4isobutoxybenzamido)acrylate
2(4chlorophenyl)2oxoethyl(2E)3(13benzodioxol5yl)2(((4(2methylpropoxy)phenyl)carbonyl)amino)prop2enoate
370071457
CC(C)COC1=CC=C(C=C1)C(=O)NC(=CC2=CC3=C(C=C2)OCO3)C(=O)OCC(=O)C4=CC=C(C=C4)Cl
CC(COc1ccc(cc1)C(=O)NC(=Cc1ccc2c(c1)OCO2)C(=O)OCC(=O)c1ccc(cc1)Cl)C
InChI=1SC29H26ClNO7c118(2)15352310621(71123)28(33)3124(13193122627(1419)38173726)29(34)361625(32)204822(30)9520h31418H1517H212H3(H3133)b2413+
MFCD00558623
ZINC000002311510
ZINC2311510
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.