Vitas-M small molecule compound

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

Catalog ID
STL038469
SMILES COc1cccc(c1)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 C25H28N4O4 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O4/c1-16-21(28-13-6-5-11-19(28)26-16)23(30)20-22(17-9-7-10-18(15-17)33-4)29(25(32)24(20)31)14-8-12-27(2)3/h5-7,9-11,13,15,22,30H,8,12,14H2,1-4H3/b23-20+
InChIKey
LDQZVSPZCXEOTR-BSYVCWPDSA-N
Synonyms
630056-95-0
(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)5(3METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(3methoxyphenyl)45dioxopyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(3METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(3METHOXYPHENYL)4((2METHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)3PYRROLIN2ONE
630056950
CC1=C(N2C=CC=CC2=N1)C(=C3C(N(C(=O)C3=O)CCCN(C)C)C4=CC(=CC=C4)OC)O
COc1cccc(c1)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1c(C)nc2n1cccc2)(O)
InChI=1SC25H28N4O4c11621(2813651119(28)2616)23(30)2022(17971018(1517)334)29(25(32)24(20)31)1481227(2)3h5791113152230H81214H214H3b2320+
MFCD18247631
ZINC000102860992
ZINC000102860996

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Available files

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