Vitas-M small molecule compound
(E)-(3-chloro-4-methoxyphenyl){1-[3-(diethylammonio)propyl]-2-(furan-2-yl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL044929
SMILES COc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CCC[NH+](CC)CC)/[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 C23H27ClN2O5 MW 446.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN2O5/c1-4-25(5-2)11-7-12-26-20(18-8-6-13-31-18)19(22(28)23(26)29)21(27)15-9-10-17(30-3)16(24)14-15/h6,8-10,13-14,20,27H,4-5,7,11-12H2,1-3H3/b21-19+InChIKey
WNPFGNKIVXHWKD-XUTLUUPISA-NSynonyms
636987-48-9(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIETHYLAMINO)PROPYL)5(FURAN2YL)PYRROLIDINE23DIONE
(4Z)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIETHYLAMINO)PROPYL)5(FURAN2YL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(1(3(diethylammonio)propyl)2(furan2yl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(1(3(DIETHYLAZANIUMYL)PROPYL)2(FURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)5(2FURYL)3HYDROXY3PYRROLIN2ONE
4(3CHLORO4METHOXYBENZOYL)1(3(DIETHYLAMINO)PROPYL)5(2FURYL)3HYDROXY15DIHYDRO2HPYRROL2ONE
636987489
CCN(CC)CCCN1C(C(=C(C2=CC(=C(C=C2)OC)Cl)O)C(=O)C1=O)C3=CC=CO3
COc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1ccco1)CCC(NH+)(CC)CC)(O)
InChI=1SC23H27ClN2O5c1425(52)117122620(1886133118)19(22(28)23(26)29)21(27)1591017(303)16(24)1415h681013142027H4571112H213H3b2119+
MFCD18248520
ZINC000102877028
ZINC000102877030
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