Vitas-M small molecule compound

(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-[4-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate

Catalog ID
STL047499
SMILES C=CCOc1ccc(cc1)C1N(CCC[NH+](C)C)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 C27H30N4O4 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O4/c1-5-17-35-20-12-10-19(11-13-20)24-22(26(33)27(34)31(24)16-8-14-29(3)4)25(32)23-18(2)28-21-9-6-7-15-30(21)23/h5-7,9-13,15,24,32H,1,8,14,16-17H2,2-4H3/b25-22+
InChIKey
FLQJGZHBJRORQD-YYDJUVGSSA-N
Synonyms
630056-98-3
(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)5(4PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(4Z)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)5(4PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)45dioxo2(4(prop2en1yloxy)phenyl)pyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2(4PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY4((2METHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)5(4PROP2ENYLOXYPHENYL)3PYRROLIN2ONE
630056983
C=CCOc1ccc(cc1)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1c(C)nc2n1cccc2)(O)
CC1=C(N2C=CC=CC2=N1)C(=C3C(N(C(=O)C3=O)CCCN(C)C)C4=CC=C(C=C4)OCC=C)O
InChI=1SC27H30N4O4c15173520121019(111320)2422(26(33)27(34)31(24)1681429(3)4)25(32)2318(2)28219671530(21)23h57913152432H18141617H224H3b2522+
MFCD18249083
ZINC000101297232
ZINC000101297235

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Available files

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