Vitas-M small molecule compound
(2E)-2-cyano-3-[3-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK179185
SMILES CCOc1cc(ccc1OCc1cccc2c1cccc2)/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 C28H28N2O4 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4/c1-2-32-27-16-20(15-23(17-29)28(31)30-18-24-10-6-14-33-24)12-13-26(27)34-19-22-9-5-8-21-7-3-4-11-25(21)22/h3-5,7-9,11-13,15-16,24H,2,6,10,14,18-19H2,1H3,(H,30,31)/b23-15+InChIKey
IZCNKPFRXBAOFV-HZHRSRAPSA-NSynonyms
(2E)2CYANO3(3ETHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)N(TETRAHYDROFURAN2YLMETHYL)PROP2ENAMIDE
(E)2CYANO3(3ETHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)N(OXOLAN2YLMETHYL)PROP2ENAMIDE
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC2CCCO2)OCC3=CC=CC4=CC=CC=C43
CCOc1cc(ccc1OCc1cccc2c1cccc2)C=C(C(=O)NCC1CCCO1)C#N
InChI=1SC28H28N2O4c1232271620(1523(1729)28(31)301824106143324)121326(27)341922958217341125(21)22h35791113151624H2610141819H21H3(H3031)b2315+
MFCD04353976
ZINC000013939812
ZINC000013939815
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