Vitas-M small molecule compound

N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-3-ethoxybenzamide

Catalog ID
STK255284
SMILES CCCC(=O)N1CCN(CC1)c1ccc(cc1Cl)NC(=O)c1cccc(c1)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 C23H28ClN3O3 MW 429.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28ClN3O3/c1-3-6-22(28)27-13-11-26(12-14-27)21-10-9-18(16-20(21)24)25-23(29)17-7-5-8-19(15-17)30-4-2/h5,7-10,15-16H,3-4,6,11-14H2,1-2H3,(H,25,29)
InChIKey
JDHGQPPNFTUVAH-UHFFFAOYSA-N
Synonyms

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)OCC)Cl
InChI=1SC23H28ClN3O3c13622(28)27131126(121427)2110918(1620(21)24)2523(29)1775819(1517)3042h57101516H3461114H212H3(H2529)
MFCD04071719
N(4(4butanoylpiperazin1yl)3chlorophenyl)3ethoxybenzamide
ZINC000009355143
ZINC09355143
ZINC9355143

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Available files

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