Vitas-M small molecule compound

(2E)-3-{4-[(2-chlorobenzyl)oxy]phenyl}-2-cyano-N-cyclopentylprop-2-enamide

Catalog ID
STK008300
SMILES N#C/C(=C\c1ccc(cc1)OCc1ccccc1Cl)/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 C22H21ClN2O2 MW 380.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O2/c23-21-8-4-1-5-17(21)15-27-20-11-9-16(10-12-20)13-18(14-24)22(26)25-19-6-2-3-7-19/h1,4-5,8-13,19H,2-3,6-7,15H2,(H,25,26)/b18-13+
InChIKey
VYVRTRJXZIKDMH-QGOAFFKASA-N
Synonyms

(2E)3(4((2CHLOROBENZYL)OXY)PHENYL)2CYANONCYCLOPENTYLPROP2ENAMIDE
(E)3(4((2CHLOROPHENYL)METHOXY)PHENYL)2CYANONCYCLOPENTYLPROP2ENAMIDE
C1CCC(C1)NC(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC=C3Cl)C#N
InChI=1SC22H21ClN2O2c2321841517(21)15272011916(101220)1318(1424)22(26)2519623719h14581319H236715H2(H2526)b1813+
MFCD06159382
N#CC(=Cc1ccc(cc1)OCc1ccccc1Cl)C(=O)NC1CCCC1
STK008300
ZINC000004550803
ZINC04550803
ZINC4550803

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Available files

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