Vitas-M small molecule compound
(E)-(3-chloro-4-ethoxyphenyl){1-[3-(diethylammonio)propyl]-2-(furan-2-yl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL149948
SMILES CCOc1ccc(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 C24H29ClN2O5 MW 460.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29ClN2O5/c1-4-26(5-2)12-8-13-27-21(19-9-7-14-32-19)20(23(29)24(27)30)22(28)16-10-11-18(31-6-3)17(25)15-16/h7,9-11,14-15,21,28H,4-6,8,12-13H2,1-3H3/b22-20+InChIKey
KTRQNYPJHHURJC-LSDHQDQOSA-NSynonyms
636988-73-3(4E)4((3CHLORO4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIETHYLAMINO)PROPYL)5(FURAN2YL)PYRROLIDINE23DIONE
(E)(3chloro4ethoxyphenyl)(1(3(diethylammonio)propyl)2(furan2yl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4ETHOXYPHENYL)(1(3(DIETHYLAZANIUMYL)PROPYL)2(FURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)4((3CHLORO4ETHOXYPHENYL)CARBONYL)5(2FURYL)3HYDROXY3PYRROLIN2ONE
636988733
CCN(CC)CCCN1C(C(=C(C2=CC(=C(C=C2)OCC)Cl)O)C(=O)C1=O)C3=CC=CO3
CCOc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1ccco1)CCC(NH+)(CC)CC)(O)
InChI=1SC24H29ClN2O5c1426(52)128132721(1997143219)20(23(29)24(27)30)22(28)16101118(3163)17(25)1516h791114152128H4681213H213H3b2220+
MFCD20755702
ZINC000009008429
ZINC000009008430
Check stock
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Check stock on Vitas-MAvailable files
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