Vitas-M small molecule compound

ethyl 3-{[(3,4-dichlorophenyl)carbonyl]amino}-4-(4-ethylpiperazin-1-yl)benzoate

Catalog ID
STK219970
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)c1ccc(c(c1)Cl)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 C22H25Cl2N3O3 MW 450.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25Cl2N3O3/c1-3-26-9-11-27(12-10-26)20-8-6-16(22(29)30-4-2)14-19(20)25-21(28)15-5-7-17(23)18(24)13-15/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,25,28)
InChIKey
QPHOBLYOVXTCSD-UHFFFAOYSA-N
Synonyms

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC(=C(C=C3)Cl)Cl
ETHYL3(((34DICHLOROPHENYL)CARBONYL)AMINO)4(4ETHYLPIPERAZIN1YL)BENZOATE
ethyl3((34dichlorobenzoyl)amino)4(4ethylpiperazin1yl)benzoate
InChI=1SC22H25Cl2N3O3c132691127(121026)208616(22(29)3042)1419(20)2521(28)155717(23)18(24)1315h581314H34912H212H3(H2528)
MFCD06665458
ZINC000010059900
ZINC10059900

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Available files

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