Vitas-M small molecule compound
(E)-(3,4-dimethoxyphenyl){1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STL037771
SMILES COc1ccc(cc1OC)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CC[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 C26H32N2O5 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O5/c1-16(2)17-7-9-18(10-8-17)23-22(25(30)26(31)28(23)14-13-27(3)4)24(29)19-11-12-20(32-5)21(15-19)33-6/h7-12,15-16,23,29H,13-14H2,1-6H3/b24-22+InChIKey
IFOVQXUHKRUSEQ-ZNTNEXAZSA-NSynonyms
615276-60-3(4E)4((34dimethoxyphenyl)hydroxymethylidene)1(2(dimethylamino)ethyl)5(4propan2ylphenyl)pyrrolidine23dione
(4E)4((34DIMETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2DIMETHYLAMINOETHYL)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
(4Z)4((34DIMETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2DIMETHYLAMINOETHYL)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
(E)(34dimethoxyphenyl)(1(2(dimethylammonio)ethyl)45dioxo2(4(propan2yl)phenyl)pyrrolidin3ylidene)methanolate
(E)(34DIMETHOXYPHENYL)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2(4PROPAN2YLPHENYL)PYRROLIDIN3YLIDENE)METHANOLATE
4((34DIMETHOXYPHENYL)CARBONYL)1(2(DIMETHYLAMINO)ETHYL)3HYDROXY5(4(METHYLETHYL)PHENYL)3PYRROLIN2ONE
615276603
CC(C)C1=CC=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OC)OC)O)C(=O)C(=O)N2CCN(C)C
COc1ccc(cc1OC)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CC(NH+)(C)C)(O)
InChI=1SC26H32N2O5c116(2)177918(10817)2322(25(30)26(31)28(23)141327(3)4)24(29)19111220(325)21(1519)336h71215162329H1314H216H3b2422+
MFCD18247486
ZINC000009123742
ZINC000009123743
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