Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Catalog ID
STL046658
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2c(C)nc3n2cccc3)/[O-])/C1c1ccc(cc1)C(=O)OC)CC
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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 C28H32N4O5 MW 504.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O5/c1-5-30(6-2)15-9-17-32-24(19-11-13-20(14-12-19)28(36)37-4)22(26(34)27(32)35)25(33)23-18(3)29-21-10-7-8-16-31(21)23/h7-8,10-14,16,24,33H,5-6,9,15,17H2,1-4H3/b25-22+InChIKey
OJNSIHQEMZVUCY-YYDJUVGSSA-NSynonyms
630064-39-0(E)(1(3(diethylammonio)propyl)2(4(methoxycarbonyl)phenyl)45dioxopyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)2(4METHOXYCARBONYLPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
630064390
CC(NH+)(CC)CCCN1C(C(=C(C2=C(N=C3N2C=CC=C3)C)(O))C(=O)C1=O)C4=CC=C(C=C4)C(=O)OC
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2c(C)nc3n2cccc3)(O))C1c1ccc(cc1)C(=O)OC)CC
InChI=1SC28H32N4O5c1530(62)159173224(19111320(141219)28(36)374)22(26(34)27(32)35)25(33)2318(3)292110781631(21)23h781014162433H5691517H214H3b2522+
METHYL4((3E)1(3(DIETHYLAMINO)PROPYL)3(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)45DIOXOPYRROLIDIN2YL)BENZOATE
METHYL4(1(3(DIETHYLAMINO)PROPYL)4HYDROXY3((2METHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)5OXO3PYRROLIN2YL)BENZOATE
MFCD18248900
ZINC000008987939
ZINC000008987951
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