Vitas-M small molecule compound

(4E)-1-[2-(diethylamino)ethyl]-5-(2-fluorophenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)pyrrolidine-2,3-dione

Catalog ID
STK617103
SMILES CCN(CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OCc2cccc(c2)C)/O)/C1c1ccccc1F)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 C31H33FN2O4 MW 516.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33FN2O4/c1-4-33(5-2)17-18-34-28(25-11-6-7-12-26(25)32)27(30(36)31(34)37)29(35)23-13-15-24(16-14-23)38-20-22-10-8-9-21(3)19-22/h6-16,19,28,35H,4-5,17-18,20H2,1-3H3/b29-27+
InChIKey
PBMWPXRUNITLFM-ORIPQNMZSA-N
Synonyms
836651-42-4
(4E)1(2(diethylamino)ethyl)5(2fluorophenyl)4(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)pyrrolidine23dione
(4E)1(2(diethylamino)ethyl)5(2fluorophenyl)4(hydroxy(4((3methylphenyl)methoxy)phenyl)methylidene)pyrrolidine23dione
(4E)1(2DIETHYLAMINOETHYL)5(2FLUOROPHENYL)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
836651424
CCN(CC)CCN1C(C(=C(C2=CC=C(C=C2)OCC3=CC=CC(=C3)C)O)C(=O)C1=O)C4=CC=CC=C4F
CCN(CCN1C(=O)C(=O)C(=C(c2ccc(cc2)OCc2cccc(c2)C)O)C1c1ccccc1F)CC
InChI=1SC31H33FN2O4c1433(52)17183428(2511671226(25)32)27(30(36)31(34)37)29(35)23131524(161423)382022108921(3)1922h616192835H45171820H213H3b2927+
MFCD08734516
ZINC000102715557
ZINC000102715559

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Available files

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