Vitas-M small molecule compound

2-(1-{[2-(3,4-diethoxyphenyl)ethyl]amino}pentylidene)-5,5-dimethylcyclohexane-1,3-dione

Catalog ID
STK681249
SMILES CCCCC(=C1C(=O)CC(CC1=O)(C)C)NCCc1ccc(c(c1)OCC)OCC

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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 C25H37NO4 MW 415.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H37NO4/c1-6-9-10-19(24-20(27)16-25(4,5)17-21(24)28)26-14-13-18-11-12-22(29-7-2)23(15-18)30-8-3/h11-12,15,26H,6-10,13-14,16-17H2,1-5H3
InChIKey
HADHWTWNTUMWPK-UHFFFAOYSA-N
Synonyms

2(1((2(34diethoxyphenyl)ethyl)amino)pentylidene)55dimethylcyclohexane13dione
2(1(2(34DIETHOXYPHENYL)ETHYLAMINO)PENTYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
CCCCC(=C1C(=O)CC(CC1=O)(C)C)NCCC2=CC(=C(C=C2)OCC)OCC
InChI=1SC25H37NO4c1691019(2420(27)1625(45)1721(24)28)26141318111222(2972)23(1518)3083h11121526H61013141617H215H3
MFCD03768758
ZINC000100140294
ZINC100140294

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Available files

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