Vitas-M small molecule compound
(E)-[2-(4-fluorophenyl)-4,5-dioxo-1-(pyridinium-2-yl)pyrrolidin-3-ylidene](4-nitrophenyl)methanolate
Catalog ID
STK563629
SMILES Fc1ccc(cc1)C1/C(=C(/c2ccc(cc2)[N+](=O)[O-])\[O-])/C(=O)C(=O)N1c1cccc[nH+]1
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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 C22H14FN3O5 MW 419.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14FN3O5/c23-15-8-4-13(5-9-15)19-18(20(27)14-6-10-16(11-7-14)26(30)31)21(28)22(29)25(19)17-3-1-2-12-24-17/h1-12,19,27H/b20-18+InChIKey
DAUHGSJLVROKBF-CZIZESTLSA-NSynonyms
371922-25-7(4E)5(4FLUOROPHENYL)4(HYDROXY(4NITROPHENYL)METHYLIDENE)1PYRIDIN2YLPYRROLIDINE23DIONE
(E)(2(4fluorophenyl)45dioxo1(pyridinium2yl)pyrrolidin3ylidene)(4nitrophenyl)methanolate
371922257
C1=CC=NC(=C1)N2C(C(=C(C3=CC=C(C=C3)(N+)(=O)(O))O)C(=O)C2=O)C4=CC=C(C=C4)F
Fc1ccc(cc1)C1C(=C(c2ccc(cc2)(N+)(=O)(O))(O))C(=O)C(=O)N1c1cccc(nH+)1
InChI=1SC22H14FN3O5c23158413(5915)1918(20(27)1461016(11714)26(30)31)21(28)22(29)25(19)17312122417h1121927Hb2018+
MFCD18244343
ZINC000102522026
ZINC000102522032
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