Vitas-M small molecule compound
(E)-(3-chloro-4-methoxyphenyl){1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(3,4,5-trimethoxyphenyl)pyrrolidin-3-ylidene}methanolate
Catalog ID
STL047363
SMILES COc1cc(cc(c1OC)OC)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)Cl)OC)/[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 C26H31ClN2O7 MW 518.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31ClN2O7/c1-28(2)10-7-11-29-22(16-13-19(34-4)25(36-6)20(14-16)35-5)21(24(31)26(29)32)23(30)15-8-9-18(33-3)17(27)12-15/h8-9,12-14,22,30H,7,10-11H2,1-6H3/b23-21+InChIKey
OTOFMITZZRLNKI-XTQSDGFTSA-NSynonyms
636987-40-1(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(345TRIMETHOXYPHENYL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(1(3(dimethylammonio)propyl)45dioxo2(345trimethoxyphenyl)pyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2(345TRIMETHOXYPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(345TRIMETHOXYPHENYL)3PYRROLIN2ONE
636987401
C(NH+)(C)CCCN1C(C(=C(C2=CC(=C(C=C2)OC)Cl)(O))C(=O)C1=O)C3=CC(=C(C(=C3)OC)OC)OC
COc1cc(cc(c1OC)OC)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1ccc(c(c1)Cl)OC)(O)
InChI=1SC26H31ClN2O7c128(2)107112922(161319(344)25(366)20(1416)355)21(24(31)26(29)32)23(30)158918(333)17(27)1215h8912142230H71011H216H3b2321+
MFCD18249053
ZINC000008818178
ZINC000102882654
Check stock
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