Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Catalog ID
STK561026
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)OC)/[O-])/C1c1ccc(cc1)C(C)C)CC
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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/c1-6-29(7-2)16-9-17-30-25(21-14-12-20(13-15-21)19(3)4)24(27(32)28(30)33)26(31)22-10-8-11-23(18-22)34-5/h8,10-15,18-19,25,31H,6-7,9,16-17H2,1-5H3/b26-24+InChIKey
BOSPKJKMNILGHC-SHHOIMCASA-NSynonyms
609325-03-3(4E)1(3(DIETHYLAMINO)PROPYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)45dioxo2(4(propan2yl)phenyl)pyrrolidin3ylidene)(3methoxyphenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)45DIOXO2(4PROPAN2YLPHENYL)PYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)3HYDROXY4((3METHOXYPHENYL)CARBONYL)5(4(METHYLETHYL)PHENYL)3PYRROLIN2ONE
609325033
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2cccc(c2)OC)(O))C1c1ccc(cc1)C(C)C)CC
CCN(CC)CCCN1C(C(=C(C2=CC(=CC=C2)OC)O)C(=O)C1=O)C3=CC=C(C=C3)C(C)C
InChI=1SC28H36N2O4c1629(72)169173025(21141220(131521)19(3)4)24(27(32)28(30)33)26(31)221081123(1822)345h8101518192531H6791617H215H3b2624+
MFCD18243690
ZINC000009236593
ZINC000009275453
Check stock
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Check stock on Vitas-MAvailable files
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