Vitas-M small molecule compound

(4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione

Catalog ID
STL149464
SMILES COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])N(C(=O)C1=O)c1cccc(c1)C(F)(F)F)/O

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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 C25H17F3N2O6 MW 498.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17F3N2O6/c1-36-19-11-7-15(8-12-19)22(31)20-21(14-5-9-17(10-6-14)30(34)35)29(24(33)23(20)32)18-4-2-3-16(13-18)25(26,27)28/h2-13,21,31H,1H3/b22-20+
InChIKey
ASCWGEMODSKYOK-LSDHQDQOSA-N
Synonyms
331751-29-2
(4E)4(hydroxy(4methoxyphenyl)methylidene)5(4nitrophenyl)1(3(trifluoromethyl)phenyl)pyrrolidine23dione
331751292
3HYDROXY4((4METHOXYPHENYL)CARBONYL)5(4NITROPHENYL)1(3(TRIFLUOROMETHYL)PHENYL)25DIHYDRO1HPYRROL2ONE
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=CC=CC(=C3)C(F)(F)F)C4=CC=C(C=C4)(N+)(=O)(O))O
COc1ccc(cc1)C(=C1C(c2ccc(cc2)(N+)(=O)(O))N(C(=O)C1=O)c1cccc(c1)C(F)(F)F)O
InChI=1SC25H17F3N2O6c1361911715(81219)22(31)2021(145917(10614)30(34)35)29(24(33)23(20)32)1842316(1318)25(2627)28h2132131H1H3b2220+
MFCD02160461
ZINC000100340498
ZINC000100340504

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Available files

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