Vitas-M small molecule compound
2-methylpropyl (2Z)-3-(1,3-benzodioxol-5-yl)-2-[(phenylcarbonyl)amino]prop-2-enoate
Catalog ID
STK650455
SMILES CC(COC(=O)/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)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 C21H21NO5 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5/c1-14(2)12-25-21(24)17(22-20(23)16-6-4-3-5-7-16)10-15-8-9-18-19(11-15)27-13-26-18/h3-11,14H,12-13H2,1-2H3,(H,22,23)/b17-10-InChIKey
DYQCSSBRULVVIL-YVLHZVERSA-NSynonyms
799835-83-9(Z)isobutyl2benzamido3(benzo(d)(13)dioxol5yl)acrylate
2methylpropyl(2Z)3(13benzodioxol5yl)2((phenylcarbonyl)amino)prop2enoate
2METHYLPROPYL(Z)2BENZAMIDO3(13BENZODIOXOL5YL)PROP2ENOATE
799835839
CC(C)COC(=O)C(=CC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3
CC(COC(=O)C(=Cc1ccc2c(c1)OCO2)NC(=O)c1ccccc1)C
InChI=1SC21H21NO5c114(2)122521(24)17(2220(23)166435716)1015891819(1115)27132618h31114H1213H212H3(H2223)b1710
MFCD03685173
ZINC000002246807
ZINC02246807
ZINC2246807
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