Vitas-M small molecule compound

(E)-{2-(4-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate

Catalog ID
STL150019
SMILES COc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2)/[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 C27H30N4O5 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O5/c1-18-23(30-12-4-3-6-21(30)28-18)25(32)22-24(19-7-9-20(35-2)10-8-19)31(27(34)26(22)33)13-5-11-29-14-16-36-17-15-29/h3-4,6-10,12,24,32H,5,11,13-17H2,1-2H3/b25-22+
InChIKey
OGLDNQHYPIFIKC-YYDJUVGSSA-N
Synonyms
630063-06-8
(4E)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)5(4METHOXYPHENYL)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
(E)(2(4METHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
3HYDROXY5(4METHOXYPHENYL)4((2METHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
630063068
CC1=C(N2C=CC=CC2=N1)C(=C3C(N(C(=O)C3=O)CCC(NH+)4CCOCC4)C5=CC=C(C=C5)OC)(O)
COc1ccc(cc1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1c(C)nc2n1cccc2)(O)
InChI=1SC27H30N4O5c11823(301243621(30)2818)25(32)2224(197920(352)10819)31(27(34)26(22)33)1351129141636171529h34610122432H5111317H212H3b2522+
MFCD20755722
ZINC000102930820
ZINC000102930821

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Available files

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