Vitas-M small molecule compound
(2E)-3-{4-[(2-chlorobenzyl)oxy]phenyl}-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK022950
SMILES N#C/C(=C\c1ccc(cc1)OCc1ccccc1Cl)/C(=O)NCC1CCCO1
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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 C22H21ClN2O3 MW 396.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O3/c23-21-6-2-1-4-17(21)15-28-19-9-7-16(8-10-19)12-18(13-24)22(26)25-14-20-5-3-11-27-20/h1-2,4,6-10,12,20H,3,5,11,14-15H2,(H,25,26)/b18-12+InChIKey
YOKQXONNOCYMKW-LDADJPATSA-NSynonyms
(2E)3(4((2CHLOROBENZYL)OXY)PHENYL)2CYANON(TETRAHYDROFURAN2YLMETHYL)PROP2ENAMIDE
(E)3(4((2CHLOROPHENYL)METHOXY)PHENYL)2CYANON(OXOLAN2YLMETHYL)PROP2ENAMIDE
C1CC(OC1)CNC(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC=C3Cl)C#N
InChI=1SC22H21ClN2O3c2321621417(21)1528199716(81019)1218(1324)22(26)25142053112720h1246101220H35111415H2(H2526)b1812+
MFCD06172320
N#CC(=Cc1ccc(cc1)OCc1ccccc1Cl)C(=O)NCC1CCCO1
STK022950
ZINC000004591245
ZINC000004591252
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