Vitas-M small molecule compound
(E)-(3-chloro-4-ethoxyphenyl){1-[3-(diethylammonio)propyl]-2-(2,5-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL045834
SMILES CCOc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1cc(OC)ccc1OC)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 C28H35ClN2O6 MW 531.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35ClN2O6/c1-6-30(7-2)14-9-15-31-25(20-17-19(35-4)11-13-22(20)36-5)24(27(33)28(31)34)26(32)18-10-12-23(37-8-3)21(29)16-18/h10-13,16-17,25,32H,6-9,14-15H2,1-5H3/b26-24+InChIKey
PIVQMPAXWJMJBJ-SHHOIMCASA-NSynonyms
615278-82-5(4E)4((3CHLORO4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIETHYLAMINO)PROPYL)5(25DIMETHOXYPHENYL)PYRROLIDINE23DIONE
(E)(3chloro4ethoxyphenyl)(1(3(diethylammonio)propyl)2(25dimethoxyphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4ETHOXYPHENYL)(1(3(DIETHYLAZANIUMYL)PROPYL)2(25DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)5(25DIMETHOXYPHENYL)4((3CHLORO4ETHOXYPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
615278825
CC(NH+)(CC)CCCN1C(C(=C(C2=CC(=C(C=C2)OCC)Cl)(O))C(=O)C1=O)C3=C(C=CC(=C3)OC)OC
CCOc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1cc(OC)ccc1OC)CCC(NH+)(CC)CC)(O)
InChI=1SC28H35ClN2O6c1630(72)149153125(201719(354)111322(20)365)24(27(33)28(31)34)26(32)18101223(3783)21(29)1618h101316172532H691415H215H3b2624+
MFCD18248721
ZINC000009044262
ZINC000009044268
Check stock
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