Vitas-M small molecule compound
(E)-(4-chlorophenyl){2-(4-fluorophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL044312
SMILES Fc1ccc(cc1)C1/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1
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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 C23H19ClFN3O3 MW 439.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClFN3O3/c24-17-6-2-16(3-7-17)21(29)19-20(15-4-8-18(25)9-5-15)28(23(31)22(19)30)12-1-11-27-13-10-26-14-27/h2-10,13-14,20,29H,1,11-12H2/b21-19+InChIKey
RSRUQVSEKUETJZ-XUTLUUPISA-NSynonyms
(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)5(4FLUOROPHENYL)1(3IMIDAZOL1YLPROPYL)PYRROLIDINE23DIONE
(E)(4chlorophenyl)(2(4fluorophenyl)1(3(1Himidazol3ium1yl)propyl)45dioxopyrrolidin3ylidene)methanolate
4((4CHLOROPHENYL)CARBONYL)5(4FLUOROPHENYL)3HYDROXY1(3(1HIMIDAZOL1YL)PROPYL)25DIHYDRO1HPYRROL2ONE
C1=CC(=CC=C1C2C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C(=O)N2CCCN4C=CN=C4)F
Fc1ccc(cc1)C1C(=C(c2ccc(cc2)Cl)(O))C(=O)C(=O)N1CCCn1cc(nH+)c1
InChI=1SC23H19ClFN3O3c24176216(3717)21(29)1920(154818(25)9515)28(23(31)22(19)30)12111271310261427h21013142029H11112H2b2119+
MFCD18248397
ZINC000102875138
ZINC000102875142
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