Vitas-M small molecule compound
(E)-(4-butoxy-3-methylphenyl){2-(4-chlorophenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL038302
SMILES CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)CC[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 C28H35ClN2O4 MW 499.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35ClN2O4/c1-5-8-17-35-23-14-11-21(18-19(23)4)26(32)24-25(20-9-12-22(29)13-10-20)31(28(34)27(24)33)16-15-30(6-2)7-3/h9-14,18,25,32H,5-8,15-17H2,1-4H3/b26-24+InChIKey
WOVKHPYWMVMALW-SHHOIMCASA-NSynonyms
497240-54-7(4E)4((4butoxy3methylphenyl)hydroxymethylidene)5(4chlorophenyl)1(2(diethylamino)ethyl)pyrrolidine23dione
(4E)4((4BUTOXY3METHYLPHENYL)HYDROXYMETHYLIDENE)5(4CHLOROPHENYL)1(2DIETHYLAMINOETHYL)PYRROLIDINE23DIONE
(E)(4butoxy3methylphenyl)(2(4chlorophenyl)1(2(diethylammonio)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4BUTOXY3METHYLPHENYL)(2(4CHLOROPHENYL)1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
497240547
CCCCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(CC)CC)C3=CC=C(C=C3)Cl)O)C
CCCCOc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)Cl)CC(NH+)(CC)CC)(O)
InChI=1SC28H35ClN2O4c158173523141121(1819(23)4)26(32)2425(2091222(29)131020)31(28(34)27(24)33)161530(62)73h914182532H581517H214H3b2624+
MFCD18247597
ZINC000102861894
ZINC000102861897
Check stock
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Check stock on Vitas-MAvailable files
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