Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-3-ylidene}(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)methanolate
Catalog ID
STL047254
SMILES COC(=O)c1ccc(cc1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2C)/[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/c1-16-8-6-14-30-21(17(2)28-25(16)30)23(32)20-22(18-9-11-19(12-10-18)27(35)36-5)31(26(34)24(20)33)15-7-13-29(3)4/h6,8-12,14,22,32H,7,13,15H2,1-5H3/b23-20+InChIKey
YVUISTOILCUTRK-BSYVCWPDSA-NSynonyms
845663-46-9(E)(1(3(dimethylammonio)propyl)2(4(methoxycarbonyl)phenyl)45dioxopyrrolidin3ylidene)(28dimethylimidazo(12a)pyridin3yl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(4METHOXYCARBONYLPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(28DIMETHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
845663469
CC1=CC=CN2C1=NC(=C2C(=C3C(N(C(=O)C3=O)CCCN(C)C)C4=CC=C(C=C4)C(=O)OC)O)C
COC(=O)c1ccc(cc1)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1c(C)nc2n1cccc2C)(O)
InChI=1SC27H30N4O5c11686143021(17(2)2825(16)30)23(32)2022(1891119(121018)27(35)365)31(26(34)24(20)33)1571329(3)4h6812142232H71315H215H3b2320+
METHYL4((3E)1(3(DIMETHYLAMINO)PROPYL)3((28DIMETHYLIMIDAZO(12A)PYRIDIN3YL)HYDROXYMETHYLIDENE)45DIOXOPYRROLIDIN2YL)BENZOATE
METHYL4(3((28DIMETHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)1(3(DIMETHYLAMINO)PROPYL)4HYDROXY5OXO3PYRROLIN2YL)BENZOATE
MFCD18249029
ZINC000102883153
ZINC000102883155
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