Vitas-M small molecule compound
(2E)-3-[4-(benzyloxy)-3-ethoxyphenyl]-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK081654
SMILES CCOc1cc(ccc1OCc1ccccc1)/C=C(/C(=O)NCC1CCCO1)\C#N
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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 C24H26N2O4 MW 406.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O4/c1-2-28-23-14-19(10-11-22(23)30-17-18-7-4-3-5-8-18)13-20(15-25)24(27)26-16-21-9-6-12-29-21/h3-5,7-8,10-11,13-14,21H,2,6,9,12,16-17H2,1H3,(H,26,27)/b20-13+InChIKey
PEPSKSWUVDPSAJ-DEDYPNTBSA-NSynonyms
(2E)3(4(BENZYLOXY)3ETHOXYPHENYL)2CYANON(TETRAHYDROFURAN2YLMETHYL)PROP2ENAMIDE
(E)2cyano3(3ethoxy4phenylmethoxyphenyl)N(oxolan2ylmethyl)prop2enamide
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC2CCCO2)OCC3=CC=CC=C3
CCOc1cc(ccc1OCc1ccccc1)C=C(C(=O)NCC1CCCO1)C#N
InChI=1SC24H26N2O4c1228231419(101122(23)3017187435818)1320(1525)24(27)26162196122921h35781011131421H269121617H21H3(H2627)b2013+
MFCD03498260
STK081654
ZINC000004671910
ZINC000004671911
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