Vitas-M small molecule compound
(2E)-3-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-2-cyano-N-cyclopentylprop-2-enamide
Catalog ID
STK084801
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCc1ccc(cc1)Cl)/C(=O)NC1CCCC1
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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 C23H23ClN2O3 MW 410.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN2O3/c1-28-22-13-17(12-18(14-25)23(27)26-20-4-2-3-5-20)8-11-21(22)29-15-16-6-9-19(24)10-7-16/h6-13,20H,2-5,15H2,1H3,(H,26,27)/b18-12+InChIKey
OLCQFSXAQPAOJJ-LDADJPATSA-NSynonyms
(2E)3(4((4CHLOROBENZYL)OXY)3METHOXYPHENYL)2CYANONCYCLOPENTYLPROP2ENAMIDE
(E)3(4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)2CYANONCYCLOPENTYLPROP2ENAMIDE
COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2CCCC2)OCC3=CC=C(C=C3)Cl
InChI=1SC23H23ClN2O3c128221317(1218(1425)23(27)2620423520)81121(22)2915166919(24)10716h61320H2515H21H3(H2627)b1812+
MFCD06145712
N#CC(=Cc1ccc(c(c1)OC)OCc1ccc(cc1)Cl)C(=O)NC1CCCC1
STK084801
ZINC000004672587
ZINC04672587
ZINC4672587
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