Vitas-M small molecule compound
(E)-{2-(2-fluorophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Catalog ID
STK562662
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)CCCn1c[nH+]cc1)/[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 C26H26FN3O4 MW 463.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26FN3O4/c1-2-16-34-19-10-8-18(9-11-19)24(31)22-23(20-6-3-4-7-21(20)27)30(26(33)25(22)32)14-5-13-29-15-12-28-17-29/h3-4,6-12,15,17,23,31H,2,5,13-14,16H2,1H3/b24-22+InChIKey
UHGPUWSPINOAPR-ZNTNEXAZSA-NSynonyms
615271-73-3(4E)5(2FLUOROPHENYL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)PYRROLIDINE23DIONE
(E)(2(2fluorophenyl)1(3(1Himidazol3ium1yl)propyl)45dioxopyrrolidin3ylidene)(4propoxyphenyl)methanolate
5(2FLUOROPHENYL)3HYDROXY1(3IMIDAZOLYLPROPYL)4((4PROPOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615271733
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=CC=C4F)O
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1F)CCCn1c(nH+)cc1)(O)
InChI=1SC26H26FN3O4c1216341910818(91119)24(31)2223(20634721(20)27)30(26(33)25(22)32)14513291512281729h3461215172331H25131416H21H3b2422+
MFCD18244092
ZINC000102514353
ZINC000102514361
Check stock
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