Vitas-M small molecule compound

ethyl 3-{[(4-chloro-3-methylphenoxy)acetyl]amino}-4-(4-ethylpiperazin-1-yl)benzoate

Catalog ID
STK189162
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)COc1ccc(c(c1)C)Cl)N1CCN(CC1)CC

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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 C24H30ClN3O4 MW 459.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30ClN3O4/c1-4-27-10-12-28(13-11-27)22-9-6-18(24(30)31-5-2)15-21(22)26-23(29)16-32-19-7-8-20(25)17(3)14-19/h6-9,14-15H,4-5,10-13,16H2,1-3H3,(H,26,29)
InChIKey
BQYAKTFNZMYENV-UHFFFAOYSA-N
Synonyms

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)COC3=CC(=C(C=C3)Cl)C
ETHYL3(((4CHLORO3METHYLPHENOXY)ACETYL)AMINO)4(4ETHYLPIPERAZIN1YL)BENZOATE
ethyl3((2(4chloro3methylphenoxy)acetyl)amino)4(4ethylpiperazin1yl)benzoate
InChI=1SC24H30ClN3O4c1427101228(131127)229618(24(30)3152)1521(22)2623(29)1632197820(25)17(3)1419h691415H45101316H213H3(H2629)
MFCD06665243
ZINC000009908027
ZINC9908027

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Available files

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