Vitas-M small molecule compound

methyl 5-({(2E)-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enoyl}amino)-2-(morpholin-4-yl)benzoate

Catalog ID
STK188694
SMILES COC(=O)c1cc(ccc1N1CCOCC1)NC(=O)/C=C/c1ccc(o1)c1ccc(cc1Cl)Cl

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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 C25H22Cl2N2O5 MW 501.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O5/c1-32-25(31)20-15-17(3-7-22(20)29-10-12-33-13-11-29)28-24(30)9-5-18-4-8-23(34-18)19-6-2-16(26)14-21(19)27/h2-9,14-15H,10-13H2,1H3,(H,28,30)/b9-5+
InChIKey
STDPCYOWARCAHE-WEVVVXLNSA-N
Synonyms

COC(=O)C1=C(C=CC(=C1)NC(=O)C=CC2=CC=C(O2)C3=C(C=C(C=C3)Cl)Cl)N4CCOCC4
COC(=O)c1cc(ccc1N1CCOCC1)NC(=O)C=Cc1ccc(o1)c1ccc(cc1Cl)Cl
InChI=1SC25H22Cl2N2O5c13225(31)201517(3722(20)29101233131129)2824(30)95184823(3418)196216(26)1421(19)27h291415H1013H21H3(H2830)b95+
METHYL5(((2E)3(5(24DICHLOROPHENYL)FURAN2YL)PROP2ENOYL)AMINO)2(MORPHOLIN4YL)BENZOATE
methyl5(((E)3(5(24dichlorophenyl)furan2yl)prop2enoyl)amino)2morpholin4ylbenzoate
MFCD06664793
ZINC000009907766
ZINC09907766
ZINC9907766

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Available files

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