Vitas-M small molecule compound
(E)-(4-butoxy-3-methylphenyl){1-[3-(dimethylammonio)propyl]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL150976
SMILES CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)CCC[NH+](C)C)/[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 C28H36N2O4 MW 464.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O4/c1-6-7-17-34-23-14-13-22(18-20(23)3)26(31)24-25(21-11-9-19(2)10-12-21)30(28(33)27(24)32)16-8-15-29(4)5/h9-14,18,25,31H,6-8,15-17H2,1-5H3/b26-24+InChIKey
RCLCUIVTGAYIIP-SHHOIMCASA-NSynonyms
500148-12-9(4E)4((4BUTOXY3METHYLPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(4METHYLPHENYL)PYRROLIDINE23DIONE
(E)(4butoxy3methylphenyl)(1(3(dimethylammonio)propyl)2(4methylphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4BUTOXY3METHYLPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(4METHYLPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
500148129
CCCCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=CC=C(C=C3)C)O)C
CCCCOc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C)CCC(NH+)(C)C)(O)
InChI=1SC28H36N2O4c167173423141322(1820(23)3)26(31)2425(2111919(2)101221)30(28(33)27(24)32)1681529(4)5h914182531H681517H215H3b2624+
MFCD20755949
ZINC000102932993
ZINC000102932996
Check stock
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