Vitas-M small molecule compound

(E)-(4-fluorophenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}methanolate

Catalog ID
STL043480
SMILES Fc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)CCC[NH+]1CCOCC1)/[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 C24H25FN2O4 MW 424.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25FN2O4/c25-19-9-7-18(8-10-19)22(28)20-21(17-5-2-1-3-6-17)27(24(30)23(20)29)12-4-11-26-13-15-31-16-14-26/h1-3,5-10,21,28H,4,11-16H2/b22-20+
InChIKey
IFIJFRGNLFUGPP-LSDHQDQOSA-N
Synonyms
381702-42-7
(4E)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)1(3MORPHOLIN4YLPROPYL)5PHENYLPYRROLIDINE23DIONE
(E)(4fluorophenyl)(1(3(morpholin4ium4yl)propyl)45dioxo2phenylpyrrolidin3ylidene)methanolate
(E)(4FLUOROPHENYL)(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2PHENYLPYRROLIDIN3YLIDENE)METHANOLATE
381702427
C1COCC(NH+)1CCCN2C(C(=C(C3=CC=C(C=C3)F)(O))C(=O)C2=O)C4=CC=CC=C4
Fc1ccc(cc1)C(=C1C(c2ccccc2)N(C(=O)C1=O)CCC(NH+)1CCOCC1)(O)
InChI=1SC24H25FN2O4c25199718(81019)22(28)2021(175213617)27(24(30)23(20)29)1241126131531161426h135102128H41116H2b2220+
MFCD18248224
ZINC000102873199
ZINC000102873202

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Available files

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