Vitas-M small molecule compound
(E)-(4-fluorophenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(3-propoxyphenyl)pyrrolidin-3-ylidene}methanolate
Catalog ID
STL046498
SMILES CCCOc1cccc(c1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1
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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 C27H31FN2O5 MW 482.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31FN2O5/c1-2-15-35-22-6-3-5-20(18-22)24-23(25(31)19-7-9-21(28)10-8-19)26(32)27(33)30(24)12-4-11-29-13-16-34-17-14-29/h3,5-10,18,24,31H,2,4,11-17H2,1H3/b25-23+InChIKey
XHHWGKADPUIAAM-WJTDDFOZSA-NSynonyms
620142-65-6(4E)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)1(3MORPHOLIN4YLPROPYL)5(3PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(4fluorophenyl)(1(3(morpholin4ium4yl)propyl)45dioxo2(3propoxyphenyl)pyrrolidin3ylidene)methanolate
(E)(4FLUOROPHENYL)(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2(3PROPOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
4((4FLUOROPHENYL)CARBONYL)3HYDROXY1(3MORPHOLIN4YLPROPYL)5(3PROPOXYPHENYL)3PYRROLIN2ONE
620142656
CCCOC1=CC=CC(=C1)C2C(=C(C3=CC=C(C=C3)F)(O))C(=O)C(=O)N2CCC(NH+)4CCOCC4
CCCOc1cccc(c1)C1C(=C(c2ccc(cc2)F)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
InChI=1SC27H31FN2O5c1215352263520(1822)2423(25(31)197921(28)10819)26(32)27(33)30(24)1241129131634171429h3510182431H241117H21H3b2523+
MFCD18248861
ZINC000009271542
ZINC000009271543
Check stock
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Check stock on Vitas-MAvailable files
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