Vitas-M small molecule compound

(2E)-2-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxybenzylidene)-N-cyclohexylhydrazinecarboxamide

Catalog ID
STK015519
SMILES CCOc1cc(/C=N/NC(=O)NC2CCCCC2)ccc1OCCOc1ccc(cc1)C(CC)C

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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 C28H39N3O4 MW 481.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H39N3O4/c1-4-21(3)23-12-14-25(15-13-23)34-17-18-35-26-16-11-22(19-27(26)33-5-2)20-29-31-28(32)30-24-9-7-6-8-10-24/h11-16,19-21,24H,4-10,17-18H2,1-3H3,(H2,30,31,32)/b29-20+
InChIKey
SARQAJXRCKPLNH-ZTKZIYFRSA-N
Synonyms

(((1E)2(3ETHOXY4(2(4(METHYLPROPYL)PHENOXY)ETHOXY)PHENYL)1AZAVINYL)AMINO)NCYCLOHEXYLCARBOXAMIDE
(2E)2(4(2(4(BUTAN2YL)PHENOXY)ETHOXY)3ETHOXYBENZYLIDENE)NCYCLOHEXYLHYDRAZINECARBOXAMIDE
1((E)(4(2(4butan2ylphenoxy)ethoxy)3ethoxyphenyl)methylideneamino)3cyclohexylurea
CCC(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=NNC(=O)NC3CCCCC3)OCC
InChI=1SC28H39N3O4c1421(3)23121425(151323)3417183526161122(1927(26)3352)20293128(32)302497681024h1116192124H4101718H213H3(H2303132)b2920+
MFCD01823864
STK015519
ZINC000008984386
ZINC000008984387

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.