Vitas-M small molecule compound

pentyl 4-({4-[2-(4-methylphenyl)-2-oxoethoxy]-4-oxobutanoyl}amino)benzoate

Catalog ID
STK247200
SMILES CCCCCOC(=O)c1ccc(cc1)NC(=O)CCC(=O)OCC(=O)c1ccc(cc1)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 C25H29NO6 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO6/c1-3-4-5-16-31-25(30)20-10-12-21(13-11-20)26-23(28)14-15-24(29)32-17-22(27)19-8-6-18(2)7-9-19/h6-13H,3-5,14-17H2,1-2H3,(H,26,28)
InChIKey
YMABHEUHIVJGKQ-UHFFFAOYSA-N
Synonyms

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)C
InChI=1SC25H29NO6c1345163125(30)20101221(131120)2623(28)141524(29)321722(27)198618(2)7919h613H351417H212H3(H2628)
MFCD01362502
PENTYL4((4(2(4METHYLPHENYL)2OXOETHOXY)4OXOBUTANOYL)AMINO)BENZOATE
ZINC000008449753
ZINC08449753
ZINC8449753

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Available files

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