Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}{4-[(3-methylbenzyl)oxy]phenyl}methanolate
Catalog ID
STL055606
SMILES C[NH+](CCN1C(c2ccc(cc2)C(C)C)/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\[O-])/C(=O)C1=O)C
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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 C32H36N2O4 MW 512.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H36N2O4/c1-21(2)24-9-11-25(12-10-24)29-28(31(36)32(37)34(29)18-17-33(4)5)30(35)26-13-15-27(16-14-26)38-20-23-8-6-7-22(3)19-23/h6-16,19,21,29,35H,17-18,20H2,1-5H3/b30-28+InChIKey
TVJVWIZUIMBIGY-SJCQXOIGSA-NSynonyms
836636-22-7(4E)1(2(dimethylamino)ethyl)4(hydroxy(4((3methylphenyl)methoxy)phenyl)methylidene)5(4propan2ylphenyl)pyrrolidine23dione
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)45dioxo2(4(propan2yl)phenyl)pyrrolidin3ylidene)(4((3methylbenzyl)oxy)phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2(4PROPAN2YLPHENYL)PYRROLIDIN3YLIDENE)(4((3METHYLPHENYL)METHOXY)PHENYL)METHANOLATE
836636227
C(NH+)(CCN1C(c2ccc(cc2)C(C)C)C(=C(c2ccc(cc2)OCc2cccc(c2)C)(O))C(=O)C1=O)C
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCN(C)C)C4=CC=C(C=C4)C(C)C)O
InChI=1SC32H36N2O4c121(2)2491125(121024)2928(31(36)32(37)34(29)181733(4)5)30(35)26131527(161426)38202386722(3)1923h61619212935H171820H215H3b3028+
MFCD18249689
ZINC000102894883
ZINC000102894885
Check stock
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