Vitas-M small molecule compound

(E)-(4-methoxyphenyl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}methanolate

Catalog ID
STL150407
SMILES CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OC)\[O-])/C(=O)C(=O)N1CC[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 C27H32N2O6 MW 480.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O6/c1-3-16-35-22-10-4-19(5-11-22)24-23(25(30)20-6-8-21(33-2)9-7-20)26(31)27(32)29(24)13-12-28-14-17-34-18-15-28/h4-11,24,30H,3,12-18H2,1-2H3/b25-23+
InChIKey
NIIZORZSHKNNGO-WJTDDFOZSA-N
Synonyms
618081-44-0
(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5(4PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(4methoxyphenyl)(1(2(morpholin4ium4yl)ethyl)45dioxo2(4propoxyphenyl)pyrrolidin3ylidene)methanolate
(E)(4METHOXYPHENYL)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2(4PROPOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
3HYDROXY4((4METHOXYPHENYL)CARBONYL)1(2MORPHOLIN4YLETHYL)5(4PROPOXYPHENYL)3PYRROLIN2ONE
618081440
CCCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OC)O)C(=O)C(=O)N2CCN4CCOCC4
CCCOc1ccc(cc1)C1C(=C(c2ccc(cc2)OC)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
InChI=1SC27H32N2O6c1316352210419(51122)2423(25(30)206821(332)9720)26(31)27(32)29(24)131228141734181528h4112430H31218H212H3b2523+
MFCD20755821
ZINC000009271259
ZINC000009271260

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Available files

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