Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-(2,6-diethylphenyl)prop-2-enamide
Catalog ID
STK111272
SMILES CCc1cccc(c1NC(=O)/C=C/c1ccc2c(c1)OCO2)CC
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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 C20H21NO3 MW 323.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO3/c1-3-15-6-5-7-16(4-2)20(15)21-19(22)11-9-14-8-10-17-18(12-14)24-13-23-17/h5-12H,3-4,13H2,1-2H3,(H,21,22)/b11-9+InChIKey
PDJFTPKVXOGVRO-PKNBQFBNSA-NSynonyms
(2E)3(13BENZODIOXOL5YL)N(26DIETHYLPHENYL)PROP2ENAMIDE
(2E)3(2HBENZO(34D)13DIOXOLAN5YL)N(26DIETHYLPHENYL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(26DIETHYLPHENYL)PROP2ENAMIDE
CCC1=C(C(=CC=C1)CC)NC(=O)C=CC2=CC3=C(C=C2)OCO3
CCc1cccc(c1NC(=O)C=Cc1ccc2c(c1)OCO2)CC
InChI=1SC20H21NO3c131565716(42)20(15)2119(22)119148101718(1214)24132317h512H3413H212H3(H2122)b119+
MFCD03376722
ZINC000000473385
ZINC00473385
ZINC473385
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