Vitas-M small molecule compound

(4-{(1Z)-2-cyano-3-oxo-3-[(3-phenylpropyl)amino]prop-1-en-1-yl}-2-methoxyphenoxy)acetic acid

Catalog ID
STK190283
SMILES N#C/C(=C/c1ccc(c(c1)OC)OCC(=O)O)/C(=O)NCCCc1ccccc1

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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 C22H22N2O5 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5/c1-28-20-13-17(9-10-19(20)29-15-21(25)26)12-18(14-23)22(27)24-11-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-10,12-13H,5,8,11,15H2,1H3,(H,24,27)(H,25,26)/b18-12-
InChIKey
UZNMBTIUYFJRRG-PDGQHHTCSA-N
Synonyms

(4((1Z)2CYANO3OXO3((3PHENYLPROPYL)AMINO)PROP1EN1YL)2METHOXYPHENOXY)ACETICACID
2(4((Z)2CYANO3KETO3(3PHENYLPROPYLAMINO)PROP1ENYL)2METHOXYPHENOXY)ACETICACID
2(4((Z)2CYANO3OXIDANYLIDENE3(3PHENYLPROPYLAMINO)PROP1ENYL)2METHOXYPHENOXY)ETHANOICACID
2(4((Z)2CYANO3OXO3(3PHENYLPROPYLAMINO)PROP1ENYL)2METHOXYPHENOXY)ACETICACID
COC1=C(C=CC(=C1)C=C(C#N)C(=O)NCCCC2=CC=CC=C2)OCC(=O)O
InChI=1SC22H22N2O5c128201317(91019(20)291521(25)26)1218(1423)22(27)241158166324716h24679101213H581115H21H3(H2427)(H2526)b1812
MFCD07546790
N#CC(=Cc1ccc(c(c1)OC)OCC(=O)O)C(=O)NCCCc1ccccc1
ZINC000004724077
ZINC4724077

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Available files

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